SCHEMBL31350344

SCHEMBL31350344

Cc1sc2ccccc2c1C(N)=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.56
IKBKB O14920 1/20 0.56
LMNA P02545 1/20 0.51
MAPK1 P28482 1/20 0.51
PLA2G10 O15496 1/20 0.49
ALDH1A1 P00352 3/20 0.46
MAPT P10636 3/20 0.46
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 2/20 0.46
GAA P10253 2/20 0.46
KMT2A Q03164 2/20 0.46
GLA P06280 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
ATM Q13315 1/20 0.46
HSD17B10 Q99714 1/20 0.46
RXFP1 Q9HBX9 2/20 0.44
PRNP P04156 1/20 0.44
MAOB P27338 1/20 0.44
MCL1 Q07820 1/20 0.43

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
Hydrochloric Acid SCHEMBL7300365 0.98 LIMK1 (0.54) LIMK1IKBKBLMNAMAPK1PLA2G10
SCHEMBL29448323 0.83 PRNP (0.53) LMNAMAPK1ALDH1A1KDM4EMEN1
SCHEMBL1398747 0.83 PRNP (0.53) LMNAMAPK1ALDH1A1KDM4EMEN1
SCHEMBL9556945 0.83 LMNA (0.49) LIMK1IKBKBLMNAMAPK1PLA2G10
SCHEMBL9756955 0.80 LMNA (0.46) LIMK1IKBKBLMNAMAPK1PLA2G10
SCHEMBL9756952 0.80 LMNA (0.46) LIMK1IKBKBLMNAMAPK1PLA2G10
SCHEMBL2688919 0.79 LIMK1 (0.62) LIMK1IKBKBLMNAMAPK1ALDH1A1
SCHEMBL10624355 0.79 LIMK1 (0.58) LIMK1IKBKBLMNAMAPK1ALDH1A1
SCHEMBL3599532 0.79 LMNA (0.71) LMNAMAPK1ALDH1A1MAPTKDM4E
SCHEMBL29483598 0.78 LIMK1 (0.68) LIMK1IKBKBLMNAMAPK1PLA2G10

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-119421879-A Novel derivatives for the treatment of TRPM3 mediated disorders 勒芬天主教大学 2025-02-11 CN claimed
CN-119421879-A Novel derivatives for the treatment of TRPM3 mediated disorders 勒芬天主教大学 2025-02-11 CN disclosed