SCHEMBL24674956

SCHEMBL24674956

C=C(C)C(=O)NCC1(C)CC1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.41
OPRL1 P41146 1/20 0.41
TGFBR1 P36897 1/20 0.34
TSHR P16473 1/20 0.33
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL18214757 0.79
SCHEMBL17784281 0.75 TGFBR1 (0.32) TGFBR1
SCHEMBL15373182 0.73
SCHEMBL23194515 0.72 OPRM1 (0.38) OPRM1OPRL1TSHR
SCHEMBL14970350 0.71 OPRM1 (0.50) OPRM1OPRL1TSHRALDH1A1
SCHEMBL59411 0.71 TGFBR1 (0.41) TGFBR1TSHRALDH1A1
SCHEMBL316224 0.71 TGFBR1 (0.41) TGFBR1TSHRALDH1A1
SCHEMBL10119331 0.70 HSD17B10 (0.41) TSHRALDH1A1
SCHEMBL7628433 0.70 OPRM1 (0.49) OPRM1OPRL1TSHRALDH1A1
SCHEMBL24675347 0.70 OPRM1 (0.45) OPRM1OPRL1TSHR

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
WO-2022223022-A1 FUSED-RING HETEROCYCLE DERIVATIVE AND MEDICAL APPLICATION THEREOF 四川海思科制药有限公司 2022-10-27 WO disclosed