SCHEMBL24746293

SCHEMBL24746293

Cc1ccc(C(=O)N2CC3CCC2C3)cc1F

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.44
NPC1 O15118 3/20 0.44
KMT2A Q03164 3/20 0.43
HSD11B1 P28845 1/20 0.43
HDAC1 Q13547 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
CHRM1 P11229 1/20 0.42
GRM5 P41594 1/20 0.41
ALDH1A1 P00352 3/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
TP53 P04637 2/20 0.38
HPGD P15428 1/20 0.38
MEN1 O00255 1/20 0.38
TSHR P16473 1/20 0.38
PRMT5 O14744 1/20 0.37
WDR77 Q9BQA1 1/20 0.37

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
SCHEMBL24746198 0.84 RAB9A (0.44) RAB9ANPC1KMT2AHSD11B1GRM5
SCHEMBL15458881 0.78 RAB9A (0.40) RAB9ANPC1KMT2AHDAC6GRM5
SCHEMBL24746302 0.76 RAB9A (0.36) RAB9ANPC1KMT2AHSD11B1GRM5
SCHEMBL19480253 0.74 HSD11B1 (0.39) KMT2AHSD11B1HDAC1HDAC6CHRM1
SCHEMBL31052658 0.73 MGLL (0.46) RAB9ANPC1KMT2AHSD11B1GRM5
SCHEMBL20070592 0.73 HDAC1 (0.44) KMT2AHSD11B1HDAC1HDAC6CHRM1
SCHEMBL17559438 0.73 PRMT5 (0.47) KMT2AHSD11B1HDAC1HDAC6CHRM1
SCHEMBL549310 0.73 GRIA3 (0.51) RAB9ANPC1KMT2AGRM5ALDH1A1
SCHEMBL19869691 0.72 BRD4 (0.54) RAB9ANPC1GRM5
SCHEMBL10203502 0.71 L3MBTL1 (0.56) ALDH1A1HPGD

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-2022174253-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2022-08-18 WO disclosed