SCHEMBL805900

SCHEMBL805900

O=[N+]([O-])c1cc(Cl)nc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
CYP19A1 P11511 1/20 0.50
HSD17B10 Q99714 1/20 0.46
TSHR P16473 6/20 0.46
GPR35 Q9HC97 1/20 0.45
TDP1 Q9NUW8 2/20 0.45
LMNA P02545 3/20 0.42
HTT P42858 2/20 0.41
VCAM1 P19320 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP3A4 P08684 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL899149 0.85 TSHR (0.48) ALDH1A1CYP19A1HSD17B10TSHRGPR35
SCHEMBL30380635 0.80 ALDH1A1 (0.44) ALDH1A1CYP19A1TSHRGPR35TDP1
SCHEMBL3016976 0.80 VCAM1 (0.48) ALDH1A1CYP19A1HSD17B10TSHRGPR35
SCHEMBL18839539 0.80 ALDH1A1 (0.44) ALDH1A1CYP19A1TSHRGPR35TDP1
SCHEMBL25371328 0.76 ALDH1A1 (0.39) ALDH1A1CYP19A1HSD17B10TSHRGPR35
SCHEMBL18839527 0.75 KMT2A (0.51) ALDH1A1TSHRGPR35LMNAHTT
SCHEMBL24150568 0.75 ALDH1A1 (0.41) ALDH1A1GPR35TDP1LMNAHTT
SCHEMBL2796279 0.75 ALDH1A1 (0.39) ALDH1A1CYP19A1HSD17B10TSHRGPR35
SCHEMBL212845 0.74 CYP19A1 (0.81) ALDH1A1CYP19A1HSD17B10TSHRGPR35
SCHEMBL1943699 0.74 CYP19A1 (0.62) ALDH1A1CYP19A1HSD17B10TSHRGPR35

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113527900-A High-performance composite waterproof material and preparation method thereof 深圳润符新材料科技有限公司 2021-10-22 CN claimed
US-9132115-B2 Lipid raft, caveolin protein, and caveolar function modulation compounds and associated synthetic and therapeutic methods KAY HEIDI (US) 2015-09-15 US claimed
US-20130253050-A1 LIPID RAFT, CAVEOLIN PROTEIN,, AND CAVEOLAR FUNCTION MODULATION COMPOUNDS AND ASSOCIATED SYNTHETIC AND THERAPEUTIC METHODS KAY HEIDI (US) 2013-09-26 US claimed
US-8425921-B1 Lipid raft, caveolin protein, and caveolar function modulation compounds and associated synthetic and therapeutic methods KAY HEIDI (US) 2013-04-23 US claimed
US-8026382-B2 Lipid raft, caveolin protein, and caveolar function modulation compounds and associated synthetic and therapeutic methods KAY HEIDI 2011-09-27 US claimed
WO-2008144616-A1 LIPID RAFT, CAVEOLIN PROTEIN, AND CAVEOLAR FUNCTION MODULATION COMPOUNDS AND ASSOCIATED SYNTHETIC AND THERAPEUTIC METHODS KAY HEIDI (US) 2008-11-27 WO claimed
US-20080286316-A1 Lipid raft, caveolin protein, and caveolar function modulation compounds and associated synthetic and therapeutic methods KAY HEIDI 2008-11-20 US claimed
WO-2007006019-A1 MATERIALS AND METHODS FOR SCREENING, DIAGNOSIS AND PROGNOSIS OF CONDITIONS ASSOCIATED WITH STAT PROTEIN EXPRESSION UNIVERSITY OF SOUTH FLORIDA (US) 2007-01-11 WO claimed
CN-122036690-A Heteroaromatic ring compound, pharmaceutical composition and application thereof 马应龙药业集团股份有限公司 2026-05-15 CN disclosed
WO-2025264959-A1 SUBSTITUTED PYRAZOLOPYRIDINES AS PHOSPHOINOSIDIDE KINASE (PIK) MODULATORS RECURSION PHARMACEUTICALS, INC. (US) 2025-12-26 WO disclosed
US-20250277066-A1 Substituted Pyridine-2,6-Bis(Phenylenephenolate) Complexes with Enhanced Solubility that are Useful as Catalyst Components for Olefin Polymerization EXXONMOBIL CHEMICAL PATENTS INC (US) 2025-09-04 US disclosed
EP-4608507-A1 COMPOUNDS AND COMPOSITIONS AS GPR52 MODULATORS Neurocrine Biosciences, Inc. (US) 2025-09-03 EP disclosed
US-20250250253-A1 SALT FORMS AND POLYMORPHS OF (R)-1-(4-(6-(2-(4-(3,3-DIFLUOROCYCLOBUTOXY)-6-METHYLPYRIDIN-2-YL)ACETAMIDO) PYRIDAZIN-3-YL)-2-FLUOROBUTYL)-N-METHYL-1H-1,2,3-TRIAZOLE-4-CARBOXAMIDE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2025-08-07 US disclosed
EP-4585265-A2 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN Takeda Pharmaceutical Company Limited (JP) 2025-07-16 EP disclosed
US-4453972-A Phenoxy pyridine derivatives and herbicidal compositions containing same CELAMERCK GMBH & CO., KG (DE) 1984-06-12 US disclosed
EP-0109640-A1 Pyridine derivatives, their preparation and their application CELAMERCK GmbH & Co. KG (DE) 1984-05-30 EP disclosed
EP-0091596-A2 Hydantoins, their preparation and application SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1983-10-19 EP disclosed
EP-0086375-A2 Pyridine derivatives, their preparation and use CELAMERCK GmbH & Co. KG (DE) 1983-08-24 EP disclosed
EP-0053306-A1 Pyridine derivatives, their preparation and uses CELAMERCK GmbH & Co. KG (DE) 1982-06-09 EP disclosed
US-3974166-A FUNGICIDE CIBA-GEIGY CORPORATION (US) 1976-08-10 US 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 (3 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-20080286316-A1 Lipid raft, caveolin protein, and caveolar function modulation compounds and associated synthetic and therapeutic methods CD4, VAPB, PXMP4 ALDH1A1 4369/4885CYP19A1 4815/4885HSD17B10 3650/4885
US-20250250253-A1 SALT FORMS AND POLYMORPHS OF (R)-1-(4-(6-(2-(4-(3,3-DIFLUOROCYCLOBUTOXY)-6-METHYLPYRIDIN-2-YL)ACETAMIDO) PYRIDAZIN-3-YL)-2-FLUOROBUTYL)-N-METHYL-1H-1,2,3-TRIAZOLE-4-CARBOXAMIDE GLS2, GLS, GLRA1 ALDH1A1 875/4885CYP19A1 4005/4885HSD17B10 2806/4885
US-20130253050-A1 LIPID RAFT, CAVEOLIN PROTEIN,, AND CAVEOLAR FUNCTION MODULATION COMPOUNDS AND ASSOCIATED SYNTHETIC AND THERAPEUTIC METHODS VAPB, CD4, VAPA ALDH1A1 4236/4885CYP19A1 4824/4885HSD17B10 3591/4885

“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.