SCHEMBL23864607

SCHEMBL23864607

COc1cccc(N(O)C(=O)c2ccccc2C(C)=O)c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ MTNR1A P48039 11/20 0.47
▸ MTNR1B P49286 11/20 0.47
▸ HSD17B2 P37059 3/20 0.46
▸ HSD17B1 P14061 2/20 0.46
▸ NPC1 O15118 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ MAPK1 P28482 1/20 0.43

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
SCHEMBL1548437 0.80 MTNR1B (0.55) HPGDKDM4EMTNR1AMTNR1BHSD17B2
SCHEMBL23864289 0.78 HIF1A (0.43) HPGDKDM4ENPC1RAB9AALDH1A1
SCHEMBL23864713 0.77 KDM4E (0.36) HPGDKDM4EALDH1A1MAPK1
SCHEMBL23864419 0.76 CRHBP (0.37) HPGDKDM4ERAB9AALDH1A1
SCHEMBL23864250 0.76 LOXL2 (0.39) RAB9AALDH1A1CYP3A4
SCHEMBL23864317 0.75 CASP3 (0.36) HPGDKDM4ENPC1RAB9AALDH1A1
SCHEMBL3215959 0.74 HSD17B2 (0.60) MTNR1AMTNR1BHSD17B2HSD17B1
SCHEMBL23864569 0.74 LMNA (0.40) HPGDNPC1RAB9AALDH1A1
SCHEMBL23864351 0.74 POLB (0.43) HPGDALDH1A1
SCHEMBL3227796 0.73 HSD17B2 (0.58) MTNR1AMTNR1BHSD17B2HSD17B1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2968330-B1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS SCRIPPS RESEARCH INST (US) 2021-09-29 — — EP disclosed
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