SCHEMBL19308530

SCHEMBL19308530

Fc1cccc(-c2ccc(-c3ccccc3)c(F)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.52
ESR2 Q92731 1/20 0.52
PDK2 Q15119 1/20 0.47
PDE3B Q13370 2/20 0.47
PDE3A Q14432 2/20 0.47
ALOX5AP P20292 1/20 0.46
FEN1 P39748 1/20 0.46
CYP11B2 P19099 1/20 0.45
PARP10 Q53GL7 1/20 0.44
PARP11 Q9NR21 1/20 0.44
PTGS1 P23219 3/20 0.44
MEN1 O00255 2/20 0.44
PTGS2 P35354 2/20 0.44
KMT2A Q03164 2/20 0.44
FABP2 P12104 1/20 0.44
TSHR P16473 1/20 0.44
AKR1C4 P17516 1/20 0.44
ADRA2B P18089 1/20 0.44
CHRM3 P20309 1/20 0.44
HTR2C P28335 1/20 0.44

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
SCHEMBL19400432 0.94 TAAR1 (0.55) TAAR1ESR2PDK2PDE3BPDE3A
SCHEMBL12384873 0.92 TAAR1 (0.55) TAAR1ESR2PDK2PDE3BPDE3A
SCHEMBL19400433 0.89 MEN1 (0.50) PDE3BPDE3AALOX5APFEN1PTGS1
SCHEMBL2140807 0.87 PTGS1 (0.49) PDE3BPDE3AALOX5APFEN1CYP11B2
SCHEMBL28566500 0.87 PTGS1 (0.49) PDE3BPDE3AALOX5APFEN1CYP11B2
SCHEMBL15077185 0.87 PTGS1 (0.49) PDE3BPDE3AALOX5APFEN1CYP11B2
SCHEMBL21363824 0.87 TAAR1 (0.47) TAAR1ESR2PDK2PDE3BPDE3A
SCHEMBL14479222 0.86 PTPRC (0.53) TAAR1ESR2PDK2PDE3BPDE3A
SCHEMBL19288225 0.86 TAAR1 (0.55) TAAR1ESR2PDK2PDE3BPDE3A
SCHEMBL18716177 0.86 CYP2C9 (0.47) PDK2PDE3BPDE3AALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240072425-A1 AROMATIC ISOTHIOCYANATES MERCK PATENT GMBH (DE) 2024-02-29 US disclosed
US-11834599-B2 Aromatic isothiocyanates MERCK PATENT GMBH (DE) 2023-12-05 US disclosed
US-11739265-B2 Aromatic isothiocyanates MERCK PATENT GMBH (DE) 2023-08-29 US disclosed
EP-3739020-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2023-08-23 EP disclosed
US-11667840-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2023-06-06 US disclosed
US-20230025385-A1 FLUORINATED AROMATIC COMPOUNDS MERCK PATENT GMBH (DE) 2023-01-26 US disclosed
WO-2022090099-A1 AROMATIC ISOTHIOCYANATES MERCK PATENT GMBH (DE) 2022-05-05 WO disclosed
US-11306251-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2022-04-19 US disclosed
US-11268026-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2022-03-08 US disclosed
EP-3433236-B1 CYANOPYRIMIDINE DERIVATIVES SUITABLE AS COMPONENTS IN LIQUID CRYSTAL MEDIA MERCK PATENT GMBH (DE) 2021-10-27 EP disclosed
US-20190185747-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2019-06-20 US disclosed
EP-2753676-B1 LIQUID-CRYSTALLINE MEDIUM AND HIGH-FREQUENCY COMPONENTS COMPRISING SAME MERCK PATENT GMBH (DE) 2019-01-23 EP disclosed
WO-2018077765-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2018-05-03 WO disclosed
US-9938462-B2 Liquid-crystalline media, components for high-frequency technology, and mesogenic compounds MERCK PATENT GMBH (DE) 2018-04-10 US disclosed
EP-2935513-B1 LIQUID-CRYSTALLINE MEDIA, COMPONENTS FOR HIGH-FREQUENCY TECHNOLOGY, AND MESOGENIC COMPOUNDS MERCK PATENT GMBH (DE) 2018-03-07 EP disclosed
WO-2018036985-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2018-03-01 WO disclosed
US-9790426-B2 Components for high-frequency technology, and liquid-crystalline media MERCK PATENT GMBH (DE) 2017-10-17 US disclosed
WO-2017162707-A1 CYANOPYRIMIDINE DERIVATIVES SUITABLE AS COMPONENTS IN LIQUID CRYSTAL MEDIA MERCK PATENT GMBH (DE) 2017-09-28 WO disclosed
US-9765259-B2 Mesogenic compounds, liquid-crystalline media and components for high-frequency technology MERCK PATENT GMBH (DE) 2017-09-19 US disclosed
US-9752077-B2 Liquid-crystalline media, components for high-frequency technology, and mesogenic compounds MERCK PATENT GMBH (DE) 2017-09-05 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 (5 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-20240072425-A1 AROMATIC ISOTHIOCYANATES TRPA1, TRPC1, CRY1 TAAR1 101/4885ESR2 3395/4885PDK2 4357/4885
US-20230025385-A1 FLUORINATED AROMATIC COMPOUNDS TRPA1, FOXM1, AFF1 TAAR1 40/4885ESR2 3581/4885PDK2 4366/4885
US-11667840-B2 Liquid-crystalline medium FES, BLM, CXCL12 TAAR1 271/4885ESR2 3456/4885PDK2 1419/4885
US-20190185747-A1 LIQUID-CRYSTALLINE MEDIUM CCNI, CCNT2, C1QBP TAAR1 1021/4885ESR2 4660/4885PDK2 4288/4885
US-11739265-B2 Aromatic isothiocyanates TRPA1, CRY1, FOXM1 TAAR1 68/4885ESR2 2846/4885PDK2 4419/4885

“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.