SCHEMBL24342133

SCHEMBL24342133

CC(C)C(=O)C1(COCNC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)CNC(=O)CCCCCN2C(=O)CC(C(C)C)C2=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 6/20 0.38
OPRK1 P41145 2/20 0.37
HRH1 P35367 1/20 0.35
OPRD1 P41143 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP7 P09237 1/20 0.34
MMP9 P14780 1/20 0.34
MMP14 P50281 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
SCHEMBL23718711 0.97 OPRL1 (0.39) OPRL1OPRK1HRH1OPRD1ALDH1A1
SCHEMBL24342135 0.93 OPRL1 (0.37) OPRL1OPRK1OPRD1ALDH1A1SMN1; SMN2
SCHEMBL23680209 0.91 OPRL1 (0.38) OPRL1OPRK1OPRD1ALDH1A1SMN1; SMN2
SCHEMBL23718792 0.91 OPRL1 (0.38) OPRL1OPRK1OPRD1ALDH1A1SMN1; SMN2
SCHEMBL24342120 0.90 OPRL1 (0.39) OPRL1OPRK1HRH1OPRD1ALDH1A1
SCHEMBL23718564 0.88 OPRL1 (0.40) OPRL1OPRK1HRH1OPRD1MMP1
SCHEMBL25649781 0.88 OPRL1 (0.41) OPRL1OPRK1OPRD1ALDH1A1SMN1; SMN2
SCHEMBL24038020 0.86 OPRL1 (0.39) OPRL1OPRK1OPRD1ALDH1A1SMN1; SMN2
SCHEMBL24343361 0.85 OPRL1 (0.39) OPRL1OPRK1OPRD1ALDH1A1SMN1; SMN2
SCHEMBL25881766 0.85 OPRL1 (0.42) OPRL1OPRD1ALDH1A1SMN1; SMN2

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-3981434-A1 ANTI-B7-H4 ANTIBODY-DRUG CONJUGATE AND MEDICINAL USE THEREOF Shanghai Hansoh Biomedical Co., Ltd. (CN) 2022-04-13 EP disclosed