SCHEMBL21098030

SCHEMBL21098030

Cc1cc(C)c(-c2c(C)cc(C)cc2S)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RAPGEF4 Q8WZA2 5/20 0.38
▸ PSMD14 O00487 1/20 0.33
▸ COPS5 Q92905 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2A6 P11509 1/20 0.31
▸ TSHR P16473 1/20 0.30

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
SCHEMBL317299 0.82 RAPGEF4 (0.50) RAPGEF4ALDH1A1KDM4ELMNAGAA
SCHEMBL15929637 0.80 RAPGEF4 (0.39) RAPGEF4ALDH1A1KDM4ELMNAGAA
SCHEMBL22064618 0.74 RAPGEF4 (0.39) RAPGEF4PSMD14COPS5ALDH1A1KDM4E
SCHEMBL1402361 0.74 RAPGEF4 (0.39) RAPGEF4PSMD14COPS5ALDH1A1KDM4E
SCHEMBL28859756 0.74 ALDH1A1 (0.58) RAPGEF4ALDH1A1KDM4ELMNAGAA
SCHEMBL19972049 0.72 KDM4E (0.46) RAPGEF4PSMD14COPS5ALDH1A1KDM4E
SCHEMBL7899006 0.71 CRHR1 (0.36) RAPGEF4PSMD14COPS5ALDH1A1KDM4E
SCHEMBL11362981 0.71 RAPGEF4 (0.41) RAPGEF4ALDH1A1KDM4ELMNAGAA
SCHEMBL11369300 0.71 RAPGEF4 (0.41) RAPGEF4ALDH1A1KDM4ELMNAGAA
SCHEMBL11496778 0.70 CYP3A4 (0.46) RAPGEF4ALDH1A1MAPT

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-11072742-B2 Liquid-crystalline media having homeotropic alignment MERCK PATENT GMBH (DE) 2021-07-27 — — US disclosed
US-20190185754-A1 LIQUID-CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2019-06-20 — — US disclosed
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