SCHEMBL26481767

SCHEMBL26481767

CCCCCc1ccc(-c2c(F)cc(-c3ccc(C)cc3)cc2F)s1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 3/20 0.38
▸ RARA P10276 1/20 0.38
▸ RARG P13631 1/20 0.38
▸ GCGR P47871 4/20 0.36
▸ KDM4E B2RXH2 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ BLM P54132 1/20 0.31

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
SCHEMBL26481762 0.90 RARB (0.49) RARBRARARARGKDM4ERAB9A
SCHEMBL26481759 0.88 RARB (0.48) RARBRARARARGKDM4ERAB9A
SCHEMBL2741574 0.82 ESR1 (0.37) RARBRARARARGKDM4ENPC1
SCHEMBL12743919 0.80 HSD17B1 (0.38) GCGRKDM4ENPC1RAB9AATM
SCHEMBL223390 0.80 RARB (0.37) RARBRARARARGKDM4ENPC1
SCHEMBL221784 0.78 RARB (0.34) RARBRARARARGNPC1RAB9A
SCHEMBL14565385 0.77 HSD17B1 (0.36) GCGRKDM4ENPC1RAB9AATM
SCHEMBL13197644 0.77 HSD17B1 (0.36) GCGRKDM4ENPC1RAB9AATM
SCHEMBL22872114 0.76 CYP11B1 (0.37) —
SCHEMBL224532 0.76 RARB (0.36) RARBRARARARGNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240067879-A1 Liquid-crystal medium MERCK PATENT GMBH (DE) 2024-02-29 — — US disclosed
US-20230323207-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2023-10-12 — — US disclosed
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