SCHEMBL29307138

SCHEMBL29307138

CSCN1CC2(CCN(C(=O)CCC(C)C)CC2)C1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 8/20 0.40
TSHR P16473 3/20 0.39
CYP1A2 P05177 4/20 0.38
USP2 O75604 4/20 0.38
HIF1A Q16665 3/20 0.38
CYP2C19 P33261 3/20 0.38
CYP2C9 P11712 2/20 0.38
HSD17B10 Q99714 1/20 0.37
ALDH1A1 P00352 1/20 0.35
CYP3A4 P08684 4/20 0.35
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
NAMPT P43490 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 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
SCHEMBL22848880 0.85 CYP2D6 (0.54) CYP2D6TSHRCYP1A2USP2HIF1A
SCHEMBL23696162 0.81 CYP2D6 (0.44) CYP2D6TSHRCYP1A2USP2HIF1A
SCHEMBL24710303 0.79 OPRM1 (0.46) CYP2D6CYP1A2CYP2C9ALDH1A1CYP3A4
SCHEMBL23560014 0.78 CYP2D6 (0.61) CYP2D6TSHRCYP1A2USP2HIF1A
SCHEMBL24673717 0.78 CYP2D6 (0.47) CYP2D6TSHRCYP2C9ALDH1A1CYP3A4
SCHEMBL23568464 0.77 OPRM1 (0.41) CYP2D6TSHRCYP1A2USP2HIF1A
SCHEMBL22848884 0.77 CYP2D6 (0.52) CYP2D6TSHRCYP1A2USP2HIF1A
SCHEMBL23807179 0.77 CYP2D6 (0.46) CYP2D6TSHRCYP1A2USP2CYP2C19
SCHEMBL20669225 0.76 NAMPT (0.39) CYP2D6TSHRCYP1A2ALDH1A1CYP3A4
SCHEMBL25468791 0.74 PDCD1 (0.38) CYP2D6TSHRCYP1A2USP2CYP2C19

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-2024148060-A1 MK2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2024-07-11 WO disclosed