SCHEMBL11755317

SCHEMBL11755317

Oc1ccc(-c2nc(S)oc2-c2ccc(Cl)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 3/20 0.44
▸ RXRB P28702 3/20 0.44
▸ RXRG P48443 3/20 0.44
▸ CNR1 P21554 2/20 0.41
▸ MEN1 O00255 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ MAPT P10636 5/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ GFER P55789 1/20 0.41
▸ VCP P55072 2/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ GAA P10253 3/20 0.38
▸ TP53 P04637 2/20 0.38
▸ MIF P14174 1/20 0.36
▸ ALOX5 P09917 2/20 0.35
▸ DEGS1 O15121 1/20 0.35

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
SCHEMBL11753981 1.00 RXRA (0.44) RXRARXRBRXRGCNR1MEN1
SCHEMBL11262728 0.92 RXRA (0.46) RXRARXRBRXRGCNR1MEN1
SCHEMBL11751140 0.92 KMT2A (0.40) RXRARXRBRXRGMEN1KMT2A
SCHEMBL11752832 0.85 RXRA (0.55) RXRARXRBRXRGMEN1KMT2A
SCHEMBL11752538 0.85 RXRA (0.55) RXRARXRBRXRGMEN1KMT2A
SCHEMBL11754855 0.85 KMT2A (0.51) RXRARXRBRXRGMEN1KMT2A
SCHEMBL11753014 0.85 KMT2A (0.51) RXRARXRBRXRGMEN1KMT2A
SCHEMBL11751493 0.84 NPC1 (0.49) RXRARXRBRXRGCNR1TP53
SCHEMBL11753438 0.84 NR4A2 (0.41) RXRARXRBRXRGCNR1MEN1
SCHEMBL11756164 0.84 NR4A2 (0.41) RXRARXRBRXRGCNR1MEN1

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-4051250-A OXAZOLE, THIAZOLE MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1977-09-27 — — US disclosed
US-3933840-A ANTIPHLOGISTIC MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1976-01-20 — — US disclosed
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