SCHEMBL29640084

SCHEMBL29640084

NC(=O)N1CCC(c2ccccn2)C1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.59
SPR P35270 1/20 0.57
USP30 Q70CQ3 1/20 0.56
KDM5A P29375 1/20 0.55
NAMPT P43490 1/20 0.50
PRMT5 O14744 4/20 0.48
WDR77 Q9BQA1 4/20 0.48
SCD5 Q86SK9 1/20 0.46
EPHX2 P34913 1/20 0.43
DRD4 P21917 3/20 0.43
POLB P06746 1/20 0.42
DRD2 P14416 2/20 0.42
MAP4K4 O95819 1/20 0.42
DRD3 P35462 1/20 0.42

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
SCHEMBL2806341 0.87 HSD11B1 (0.60) HSD11B1SPRUSP30KDM5ANAMPT
SCHEMBL12791432 0.82 HSD11B1 (0.56) HSD11B1SPRUSP30KDM5ANAMPT
SCHEMBL4074303 0.80 HSD11B1 (0.53) HSD11B1SPRUSP30KDM5ANAMPT
SCHEMBL19961308 0.80 ALDH1A1 (0.67) HSD11B1SPRUSP30KDM5APOLB
SCHEMBL6347014 0.79 HSD11B1 (0.53) HSD11B1SPRUSP30KDM5ANAMPT
SCHEMBL14413688 0.79 CYP2C9 (0.52) HSD11B1SPRUSP30KDM5ANAMPT
SCHEMBL14781405 0.79 HSD11B1 (0.52) HSD11B1SPRUSP30KDM5ADRD4
SCHEMBL18115645 0.79 GPR119 (0.59) HSD11B1SPRUSP30KDM5APRMT5
SCHEMBL19961306 0.78 RAB9A (0.69) HSD11B1SPRUSP30KDM5APOLB
SCHEMBL15755669 0.78 HSD11B1 (0.51) HSD11B1SPRUSP30KDM5ADRD4

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
CN-114450271-B Ureas, amino and substituted heteroaryl compounds for Cbl-b inhibition 纽力克斯治疗公司 2024-09-20 CN disclosed
CN-114450271-A Ureas, amino and substituted heteroaryl compounds for Cbl-b inhibition 纽力克斯治疗公司 2022-05-06 CN disclosed