SCHEMBL11753577

SCHEMBL11753577

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

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ NR4A2 P43354 3/20 0.40
▸ RXRA P19793 2/20 0.39
▸ RXRB P28702 2/20 0.39
▸ RXRG P48443 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ GFER P55789 1/20 0.39
▸ ESR1 P03372 8/20 0.38
▸ ESR2 Q92731 8/20 0.38
▸ CNR1 P21554 2/20 0.37
▸ NR4A1 P22736 1/20 0.37
▸ NR4A3 Q92570 1/20 0.37
▸ POLB P06746 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HSD17B10 Q99714 1/20 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
SCHEMBL11749112 0.95 RXRA (0.46) MEN1KMT2ANR4A2RXRARXRB
SCHEMBL11748112 0.95 RXRA (0.46) MEN1KMT2ANR4A2RXRARXRB
SCHEMBL11748931 0.93 MEN1 (0.51) MEN1KMT2ANR4A2RXRARXRB
SCHEMBL11752077 0.93 MEN1 (0.51) MEN1KMT2ANR4A2RXRARXRB
SCHEMBL11752390 0.84 RXRA (0.48) MEN1KMT2ANR4A2RXRARXRB
SCHEMBL11752484 0.81 RXRA (0.46) MEN1KMT2ANR4A2RXRARXRB
SCHEMBL11751989 0.81 MAPK14 (0.50) NR4A2POLBHPGDHSD17B10
SCHEMBL11753348 0.81 NR4A2 (0.47) MEN1KMT2ANR4A2RXRARXRB
SCHEMBL11753407 0.81 NR4A2 (0.39) KMT2ANR4A2RXRARXRBRXRG
SCHEMBL6025571 0.80 NR4A2 (0.60) NR4A2RXRARXRBRXRGALDH1A1

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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