SCHEMBL9695388

SCHEMBL9695388

CCCc1cnc(-c2ccc(C(=O)Cl)cc2)nc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 1/20 0.58
▸ SMN1; SMN2 Q16637 7/20 0.52
▸ RAB9A P51151 5/20 0.52
▸ NPC1 O15118 4/20 0.52
▸ TP53 P04637 1/20 0.52
▸ MAPT P10636 3/20 0.43
▸ THRB P10828 3/20 0.43
▸ NFKB1 P19838 1/20 0.43
▸ NFKB2 Q00653 1/20 0.43
▸ RELA Q04206 1/20 0.43
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ CA12 O43570 3/20 0.41
▸ CA1 P00915 3/20 0.41
▸ CA2 P00918 3/20 0.41
▸ CA6 P23280 3/20 0.41
▸ CA7 P43166 3/20 0.41
▸ CA13 Q8N1Q1 3/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41

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
SCHEMBL9323779 0.88 RARB (0.77) RARBSMN1; SMN2RAB9ANPC1MAPT
SCHEMBL9746639 0.88 RARB (0.77) RARBSMN1; SMN2RAB9ANPC1MAPT
SCHEMBL9744770 0.88 RARB (0.77) RARBSMN1; SMN2RAB9ANPC1MAPT
SCHEMBL7767493 0.88 RARB (0.77) RARBSMN1; SMN2RAB9ANPC1MAPT
SCHEMBL6024538 0.88 RARB (0.77) RARBSMN1; SMN2RAB9ANPC1MAPT
SCHEMBL9746425 0.88 RARB (0.77) RARBSMN1; SMN2RAB9ANPC1MAPT
SCHEMBL11613422 0.87 SMN1; SMN2 (0.49) RARBSMN1; SMN2RAB9ANPC1TP53
SCHEMBL10669382 0.87 RAB9A (0.50) RARBSMN1; SMN2RAB9ANPC1TP53
SCHEMBL28903371 0.85 RARB (0.78) RARBSMN1; SMN2RAB9ANPC1TP53
SCHEMBL9238965 0.81 RARB (0.72) RARBSMN1; SMN2RAB9ANPC1TP53

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
CN-112029514-B Polymer-stabilized blue-phase liquid crystal composition and preparation method thereof 清华大学 2021-11-30 — — CN disclosed
CN-112029514-A Polymer-stabilized blue-phase liquid crystal composition and preparation method thereof 清华大学 2020-12-04 — — CN disclosed
US-5124068-A Liquid crystal displays MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-06-23 — — US disclosed
US-5043093-A Liquid crystals MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-08-27 — — US disclosed
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