SCHEMBL9563371

SCHEMBL9563371

CCC[C@H](C)c1ccccc1-c1ccc(O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.42
ABCB1 P08183 2/20 0.42
BCR P11274 2/20 0.42
TSHR P16473 1/20 0.42
ESR2 Q92731 2/20 0.39
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
ESR1 P03372 3/20 0.37
MMP3 P08254 1/20 0.36
BCL2L1 Q07817 1/20 0.36
LTB4R2 Q9NPC1 1/20 0.36
PTPN1 P18031 1/20 0.36
BACE1 P56817 1/20 0.36
PPARA Q07869 2/20 0.35
PPARG P37231 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
USP7 Q93009 2/20 0.35

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
SCHEMBL9563375 1.00 ABL1 (0.42) ABL1ABCB1BCRTSHRESR2
SCHEMBL28114560 0.86 TSHR (0.58) ABL1ABCB1BCRTSHRESR2
SCHEMBL15536289 0.86 KDM4E (0.40) TSHRCA12CA1CA2CA9
SCHEMBL28498988 0.85 ABL1 (0.43) ABL1ABCB1BCRESR2ESR1
SCHEMBL8162585 0.84 FFAR1 (0.40) ABL1ABCB1BCRTSHRESR2
SCHEMBL9563378 0.81 ESR2 (0.49) TSHRESR2ESR1BACE1NPC1
SCHEMBL1537497 0.80 CYP11B2 (0.39) TSHRCA12CA1CA2CA9
SCHEMBL28066753 0.80 ESR1 (0.41) ESR2ESR1ALDH1A1
SCHEMBL982415 0.79 TSHR (0.53) TSHRBCL2L1RAB9AALDH1A1
SCHEMBL29538333 0.79 HNF4A (0.41) TSHRCA1CA2BCL2L1BACE1

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
EP-0542305-A2 High polymer and ferroelectric liquid crystal composition utilizing same IDEMITSU KOSAN COMPANY LIMITED (JP) 1993-05-19 EP disclosed