SCHEMBL26481759

SCHEMBL26481759

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 11/20 0.48
▸ RARA P10276 2/20 0.48
▸ RARG P13631 1/20 0.48
▸ KDM4E B2RXH2 3/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ MAPT P10636 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ MTOR P42345 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.37
▸ AKR1C2 P52895 1/20 0.36
▸ AKR1C1 Q04828 1/20 0.36
▸ ESR1 P03372 2/20 0.36
▸ ADRA2A P08913 2/20 0.36
▸ ADORA3 P0DMS8 2/20 0.36
▸ TACR2 P21452 2/20 0.36

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 0.99 RARB (0.49) RARBRARARARGKDM4ERAB9A
SCHEMBL26481767 0.88 RARB (0.38) RARBRARARARGKDM4ERAB9A
SCHEMBL223390 0.87 RARB (0.37) RARBRARARARGKDM4ERAB9A
SCHEMBL224532 0.83 RARB (0.36) RARBRARARARGRAB9AHSD17B10
SCHEMBL221784 0.83 RARB (0.34) RARBRARARARGRAB9AHSD17B10
SCHEMBL11017540 0.82 KDM4E (0.49) RARBRARAKDM4ERAB9AHSD17B10
SCHEMBL11015834 0.82 KDM4E (0.49) RARBRARARARGKDM4ERAB9A
SCHEMBL26481798 0.81 RARB (0.45) RARBRARARARGKDM4ERAB9A
SCHEMBL224937 0.81 RARB (0.56) RARBRARARARGKDM4ERAB9A
SCHEMBL1533783 0.81 RARB (0.47) RARBRARARARGKDM4ERAB9A

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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