SCHEMBL11770943

SCHEMBL11770943

CCNC(=O)Nc1cc(C)c(Sc2cc(Cl)ccc2C)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.46
▸ CNR1 P21554 3/20 0.43
▸ MAPT P10636 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ EPHX2 P34913 1/20 0.41
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ EPHX1 P07099 3/20 0.40
▸ IDH1 O75874 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39

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
SCHEMBL11768383 0.88 LMNA (0.48) CNR1MAPTALDH1A1POLBGAA
SCHEMBL11771440 0.85 ALDH1A1 (0.51) CNR1MAPTALDH1A1POLBGAA
SCHEMBL11770865 0.80 CNR1 (0.42) TSHRCNR1MAPTEPHX2NPC1
SCHEMBL11769064 0.78 ALDH1A1 (0.49) TSHRMAPTALDH1A1EPHX2NPC1
SCHEMBL11772552 0.76 MEN1 (0.51) TSHRCNR1MAPTALDH1A1EPHX2
SCHEMBL11768422 0.75 ALDH1A1 (0.49) MAPTALDH1A1NPC1RAB9A
SCHEMBL11769792 0.75 MTNR1B (0.50) TSHRMAPTNPC1RAB9APOLB
SCHEMBL11773295 0.74 MEN1 (0.51) CNR1MAPTALDH1A1EPHX2NPC1
SCHEMBL10073226 0.74 MAPT (0.44) MAPTALDH1A1EPHX2NPC1RAB9A
SCHEMBL26463986 0.73 ALDH1A1 (0.62) TSHRCNR1MAPTALDH1A1EPHX2

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-3970752-A Coccidiocidal compositions utilizing 1-phenyl-substituted 1,3,5-triazine BAYER AKTIENGESELLSCHAFT (DT) 1976-07-20 — — US disclosed
US-3948893-A COCCIDIOSIS BAYER AKTIENGESELLSCHAFT (DT) 1976-04-06 — — US disclosed
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