SCHEMBL9494645

SCHEMBL9494645

CCCCCc1ccc(-c2ccc(-c3ccc(OCCCC)cc3)c(F)c2F)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.57
MEN1 O00255 1/20 0.57
USP2 O75604 1/20 0.57
ALDH1A1 P00352 1/20 0.57
LMNA P02545 1/20 0.57
MAPK1 P28482 1/20 0.57
CASP1 P29466 1/20 0.57
KMT2A Q03164 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
SLCO1B3 Q9NPD5 1/20 0.57
SLCO1B1 Q9Y6L6 1/20 0.57
MAPT P10636 1/20 0.49
RAB9A P51151 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
RARB P10826 1/20 0.48
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
TSHR P16473 1/20 0.45

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
SCHEMBL9494683 0.98 MEN1 (0.59) CYP3A4MEN1USP2ALDH1A1LMNA
SCHEMBL9494790 0.98 CYP3A4 (0.56) CYP3A4MEN1USP2ALDH1A1LMNA
SCHEMBL9493011 0.97 MEN1 (0.58) CYP3A4MEN1USP2ALDH1A1LMNA
SCHEMBL10533751 0.97 MEN1 (0.58) CYP3A4MEN1USP2ALDH1A1LMNA
SCHEMBL9494070 0.97 MEN1 (0.58) CYP3A4MEN1USP2ALDH1A1LMNA
SCHEMBL9493809 0.97 MEN1 (0.58) CYP3A4MEN1USP2ALDH1A1LMNA
SCHEMBL9493415 0.97 LMNA (0.55) CYP3A4MEN1USP2ALDH1A1LMNA
SCHEMBL9497102 0.97 MEN1 (0.58) CYP3A4MEN1USP2ALDH1A1LMNA
SCHEMBL9497822 0.97 MEN1 (0.58) CYP3A4MEN1USP2ALDH1A1LMNA
SCHEMBL9493235 0.97 MEN1 (0.58) CYP3A4MEN1USP2ALDH1A1LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265345-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND APPLICATION OF LIQUID CRYSTAL COMPOSITION BEIJING BAYI SPACE LCD TECHNOLOGY CO., LTD. (CN) 2023-08-24 US disclosed
US-5273680-A A chiral tilted smectic liquid crystal based on terphenyls MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-12-28 US disclosed
EP-0329752-B1 FLUORINATED OLIGOPHENYLS AND THEIR USE IN LIQUID CRYSTAL MATERIALS MERCK PATENT GmbH (DE) 1993-03-17 EP disclosed
EP-0329752-A1 FLUORINATED OLIGOPHENYLS AND THEIR USE IN LIQUID CRYSTAL MATERIALS MERCK PATENT GmbH (DE) 1989-08-30 EP disclosed