SCHEMBL10469441

SCHEMBL10469441

CCCNc1nc(O)c(F)cc1C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 6/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 3/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 1/20 0.37
LMNA P02545 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
RIPK1 Q13546 1/20 0.36
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
MAPT P10636 1/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA7 P43166 2/20 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
SCHEMBL10467363 0.89 ALDH1A1 (0.47) CHRNA7SMN1; SMN2ALDH1A1KDM4EHPGD
SCHEMBL10467030 0.88 PGK1 (0.38) CHRNA7SMN1; SMN2ALDH1A1KDM4EHPGD
SCHEMBL10469372 0.88 ALDH1A1 (0.42) CHRNA7SMN1; SMN2ALDH1A1KDM4EHPGD
SCHEMBL10468342 0.85 ESR1 (0.45) ALDH1A1HSD17B10TDP1L3MBTL1CYP1A2
SCHEMBL10467486 0.85 KDM6B (0.42) CHRNA7SMN1; SMN2ALDH1A1KDM4EHPGD
SCHEMBL10469476 0.85 CHRNA7 (0.38) CHRNA7SMN1; SMN2ALDH1A1KDM4EHPGD
SCHEMBL10467364 0.84 SMN1; SMN2 (0.40) CHRNA7SMN1; SMN2ALDH1A1KDM4EHPGD
SCHEMBL10468277 0.84 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10468696 0.84 KDM4E (0.39) SMN1; SMN2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL14927568 0.81 KEAP1 (0.39) CHRNA7SMN1; SMN2ALDH1A1KDM4EHPGD

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
US-4916229-A Pyridine carboxylic acid derivates WARNER-LAMBERT COMPANY (US) 1990-04-10 US disclosed