SCHEMBL23680209

SCHEMBL23680209

CC(C)C(=O)C1(COCNC(=O)CNC(=O)C(Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)CCCCCN2C(=O)CC(C(C)(C)C)C2=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 6/20 0.38
OPRK1 P41145 2/20 0.37
AKT1 P31749 1/20 0.35
OPRD1 P41143 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL23718792 1.00 OPRL1 (0.38) OPRL1OPRK1AKT1OPRD1ALDH1A1
SCHEMBL23718564 0.97 OPRL1 (0.40) OPRL1OPRK1AKT1OPRD1
SCHEMBL24037651 0.93 OPRL1 (0.37) OPRL1OPRK1AKT1OPRD1ALDH1A1
SCHEMBL24342133 0.91 OPRL1 (0.38) OPRL1OPRK1OPRD1ALDH1A1SMN1; SMN2
SCHEMBL24037983 0.90 OPRL1 (0.39) OPRL1OPRK1AKT1OPRD1ALDH1A1
SCHEMBL23718711 0.88 OPRL1 (0.39) OPRL1OPRK1OPRD1ALDH1A1SMN1; SMN2
SCHEMBL25533497 0.87 FOLH1 (0.35) OPRL1OPRK1ALDH1A1SMN1; SMN2
SCHEMBL24038011 0.87 OPRL1 (0.39) OPRL1OPRK1AKT1OPRD1ALDH1A1
SCHEMBL26067120 0.87 OPRL1 (0.41) OPRL1OPRK1AKT1OPRD1ALDH1A1
SCHEMBL24038006 0.86 OPRL1 (0.39) OPRL1OPRK1AKT1OPRD1ALDH1A1

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
EP-4129345-A1 PHARMACEUTICAL COMPOSITION COMPRISING ANTIBODY DRUG CONJUGATE AND USE THEREOF Jiangsu Hengrui Pharmaceuticals Co., Ltd. (CN) 2023-02-08 EP disclosed
EP-3854816-A1 ANTI-B7H3 ANTIBODY-EXATECAN ANALOG CONJUGATE AND MEDICINAL USE THEREOF Jiangsu Hengrui Medicine Co., Ltd. (CN) 2021-07-28 EP disclosed