SCHEMBL9563740

SCHEMBL9563740

CCCCCCCCCc1ccc(-c2ccc(-c3ccc(-c4ccc(OCC)cc4)cc3)c(F)c2F)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
RAB9A P51151 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
MEN1 O00255 3/20 0.50
ALDH1A1 P00352 3/20 0.50
KMT2A Q03164 3/20 0.50
USP2 O75604 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAPK1 P28482 1/20 0.50
CASP1 P29466 1/20 0.50
SLCO1B3 Q9NPD5 1/20 0.50
SLCO1B1 Q9Y6L6 1/20 0.50
HSD17B10 Q99714 2/20 0.49
TSHR P16473 1/20 0.49
RARB P10826 8/20 0.48
RARA P10276 2/20 0.45
RARG P13631 1/20 0.45
MTOR P42345 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
SCHEMBL9563679 1.00 MAPT (0.56) MAPTRAB9AL3MBTL1MEN1ALDH1A1
SCHEMBL9563809 1.00 MAPT (0.56) MAPTRAB9AL3MBTL1MEN1ALDH1A1
SCHEMBL9563845 1.00 MAPT (0.56) MAPTRAB9AL3MBTL1MEN1ALDH1A1
SCHEMBL9563964 1.00 MAPT (0.56) MAPTRAB9AL3MBTL1MEN1ALDH1A1
SCHEMBL9564003 1.00 MAPT (0.56) MAPTRAB9AL3MBTL1MEN1ALDH1A1
SCHEMBL9494188 0.99 MAPT (0.57) MAPTRAB9AL3MBTL1MEN1ALDH1A1
SCHEMBL9563699 0.99 MAPT (0.57) MAPTRAB9AL3MBTL1MEN1ALDH1A1
SCHEMBL9497724 0.97 MAPT (0.58) MAPTRAB9AL3MBTL1MEN1ALDH1A1
SCHEMBL9563820 0.94 MAPT (0.51) MAPTRAB9AL3MBTL1MEN1ALDH1A1
SCHEMBL9563698 0.93 CYP3A4 (0.58) MAPTRAB9AL3MBTL1MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5273680-A A chiral tilted smectic liquid crystal based on terphenyls MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-12-28 US disclosed