SCHEMBL6735248

SCHEMBL6735248

O=Cc1cc(F)c(Br)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KDM1A O60341 2/20 0.35
KDM1B Q8NB78 1/20 0.35
KIF11 P52732 1/20 0.34
XDH P47989 1/20 0.32
ERN1 O75460 1/20 0.32
CYP2A6 P11509 1/20 0.32
KDM4E B2RXH2 1/20 0.31
PTGS2 P35354 1/20 0.31
RAB9A P51151 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19948930 0.84 SRC (0.39) ALDH1A1SMN1; SMN2KIF11CYP2A6PTGS2
SCHEMBL29957050 0.84 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2KDM1AKDM1BKIF11
SCHEMBL29655021 0.78 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2KIF11
SCHEMBL19748916 0.78 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2KIF11
SCHEMBL48658 0.78 CES2 (0.42) ALDH1A1SMN1; SMN2KIF11XDHERN1
SCHEMBL6738427 0.76 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2KIF11XDHERN1
SCHEMBL1811153 0.76 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2KIF11XDHERN1
SCHEMBL31063495 0.75 ERN1 (0.44) XDHERN1
SCHEMBL987816 0.75 ERN1 (0.44) XDHERN1
SCHEMBL22490227 0.75 ALDH1A3 (0.37) ALDH1A1SMN1; SMN2CYP2A6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 69 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108947782-B Bromofluoride multi-substituted benzaldehyde derivative and preparation method thereof 上海罕道医药科技有限公司 2021-08-24 CN claimed
EP-4729059-A2 THIAZOLO [5,4-B] PYRIDINE MALT-1 INHIBITORS Abbvie Inc. (US) 2026-04-22 EP disclosed
US-12606533-B2 3-phenylpropylamine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2026-04-21 US disclosed
US-20260035363-A1 COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS MERCK SHARP & DOHME LLC (US) 2026-02-05 US disclosed
EP-4666856-A2 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO Corteva Agriscience LLC (US) 2025-12-24 EP disclosed
US-12490741-B2 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto CORTEVA AGRISCIENCE LLC (US) 2025-12-09 US disclosed
US-20250359552-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2025-11-27 US disclosed
US-20250353824-A1 3-PHENYLPROPYLAMINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2025-11-20 US disclosed
US-12459933-B2 Compounds and methods of use thereof as antibacterial agents MERCK SHARP & DOHME LLC (US) 2025-11-04 US disclosed
EP-3578543-B1 COMPOSITIONS COMPRISING MOLECULES HAVING PESTICIDAL UTILITY AND PROCESSES RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2025-08-20 EP disclosed
US-9795139-B2 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2017-10-24 US disclosed
US-9781935-B2 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2017-10-10 US disclosed
WO-2016168059-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2016-10-20 WO disclosed
WO-2016168056-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITION, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2016-10-20 WO disclosed
US-20160304522-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2016-10-20 US disclosed
US-20160302417-A1 Molecules Having Pesticidal Utility, and Intermediates, Compositions, and Processes, Related Thereto DOW AGROSCIENCES LLC (US) 2016-10-20 US disclosed
US-6682785-B2 A FLUOROANTHRACENE COMPOUNDS; HEAT RESISTANCE, RADIATION RESISTANCE, PHOTOSTABILITY CLARIANT FINANCE (BVI) LIMITED (VG) 2004-01-27 US disclosed
US-20030118749-A1 A fluoroanthracene compounds; heat resistance, radiation resistance, photostability CLARIANT INTERNATIONAL LTD. 2003-06-26 US disclosed
US-5354502-A Very large dielectric anisotropy and small birefringence SEIKO EPSON CORPORATION (JP) 1994-10-11 US disclosed
EP-0447565-A1 1,3-DIOXANE DERIVATIVE AND LIQUID-CRYSTAL COMPOSITION CONTAINING THE SAME SEIKO EPSON CORPORATION (JP) 1991-09-25 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030118749-A1 A fluoroanthracene compounds; heat resistance, radiation resistance, photostability HSF1, ABCC1, FLNA ALDH1A1 298/4885SMN1; SMN2 4864/4885KDM1A 4293/4885
US-12459933-B2 Compounds and methods of use thereof as antibacterial agents NDUFB7, MRPL21, SQLE ALDH1A1 107/4885SMN1; SMN2 3056/4885KDM1A 3861/4885
US-20250353824-A1 3-PHENYLPROPYLAMINE DERIVATIVE SF1, SF3A1, SFXN1 ALDH1A1 358/4885SMN1; SMN2 1764/4885KDM1A 126/4885
US-20160304522-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto ACHE, DDT, MLYCD ALDH1A1 443/4885SMN1; SMN2 3645/4885KDM1A 1074/4885
US-12606533-B2 3-phenylpropylamine derivative SF3A1, SF1, HTR1D ALDH1A1 357/4885SMN1; SMN2 707/4885KDM1A 76/4885
US-20260035363-A1 COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS CBR3, CBR1, NR3C2 ALDH1A1 746/4885SMN1; SMN2 3828/4885KDM1A 3722/4885
US-20160302417-A1 Molecules Having Pesticidal Utility, and Intermediates, Compositions, and Processes, Related Thereto ACHE, DDT, MLYCD ALDH1A1 443/4885SMN1; SMN2 3645/4885KDM1A 1074/4885
US-20250359552-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO ACHE, DDT, MLYCD ALDH1A1 443/4885SMN1; SMN2 3645/4885KDM1A 1074/4885
US-12490741-B2 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto ACHE, DDT, MLYCD ALDH1A1 443/4885SMN1; SMN2 3645/4885KDM1A 1074/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.