SCHEMBL24935017

SCHEMBL24935017

Cc1ccc(NC(=O)Cc2ccc(C(=O)C(C)C)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.64
GAA P10253 2/20 0.64
RAB9A P51151 2/20 0.60
EPHX2 P34913 1/20 0.53
POLB P06746 1/20 0.53
NLRP3 Q96P20 1/20 0.52
HPGD P15428 2/20 0.51
MEN1 O00255 6/20 0.51
KMT2A Q03164 6/20 0.51
ATM Q13315 1/20 0.51
MAPK1 P28482 1/20 0.51
ALDH1A1 P00352 1/20 0.51
MAPT P10636 1/20 0.51
NPC1 O15118 1/20 0.50
KDM4E B2RXH2 1/20 0.48
CACNA1B Q00975 1/20 0.48
APBA1 Q02410 1/20 0.48
HSD17B10 Q99714 1/20 0.48
P2RY14 Q15391 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL25064118 0.87 NLRP3 (0.58) SMN1; SMN2GAARAB9APOLBNLRP3
SCHEMBL16542117 0.86 SMN1; SMN2 (0.83) SMN1; SMN2GAARAB9AEPHX2POLB
SCHEMBL24935013 0.83 MEN1 (0.71) SMN1; SMN2GAARAB9AEPHX2POLB
SCHEMBL23598255 0.80 SMN1; SMN2 (0.61) SMN1; SMN2GAARAB9AEPHX2POLB
SCHEMBL2456637 0.80 SMN1; SMN2 (0.73) SMN1; SMN2GAARAB9AEPHX2POLB
SCHEMBL24935012 0.80 SMN1; SMN2 (0.73) SMN1; SMN2GAARAB9AEPHX2POLB
SCHEMBL24819419 0.80 SMN1; SMN2 (0.73) SMN1; SMN2GAARAB9AEPHX2POLB
SCHEMBL22758337 0.78 SMN1; SMN2 (0.71) SMN1; SMN2GAARAB9AEPHX2POLB
SCHEMBL10746702 0.78 MEN1 (0.71) SMN1; SMN2GAARAB9APOLBHPGD
SCHEMBL17183464 0.78 SMN1; SMN2 (1.00) SMN1; SMN2GAARAB9AEPHX2POLB

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-4119546-A1 BIFUNCTIONAL COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF Suzhou Kintor Pharmaceuticals, Inc. (CN) 2023-01-18 EP disclosed