SCHEMBL9686958

SCHEMBL9686958

O=C(O)Oc1cn(C2CC2)c2nc(N3CCNCC3)c(Cl)cc2c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
CYP2C9 P11712 2/20 0.41
ATP6V1B2 P21281 1/20 0.41
TBXA2R P21731 1/20 0.41
EDNRA P25101 1/20 0.41
TARBP2 Q15633 1/20 0.41
KDM4E B2RXH2 3/20 0.41
HSD17B10 Q99714 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
CYP1A2 P05177 1/20 0.41
TOP2A P11388 1/20 0.41
TOP2B Q02880 1/20 0.41
DPP4 P27487 6/20 0.40
CHRM2 P08172 1/20 0.36
DRD1 P21728 1/20 0.36
ABCC4 O15439 1/20 0.34
DHFR P00374 1/20 0.34
POLB P06746 1/20 0.32
PRKD3 O94806 1/20 0.32

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
SCHEMBL9687448 0.88 LMNA (0.55) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9687780 0.88 DPP4 (0.40) LMNAKDM4EHSD17B10DPP4CHRM2
SCHEMBL9686860 0.88 KDM4E (0.44) LMNAKDM4EHSD17B10ALDH1A1HPGD
Hydrochloric Acid SCHEMBL9687485 0.87 DPP4 (0.40) LMNAKDM4EHSD17B10DPP4CHRM2
SCHEMBL9686951 0.87 KDM4E (0.54) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9686531 0.86 LMNA (0.43) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9687532 0.85 CYP2C9 (0.39) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9687446 0.84 DPP4 (0.43) DPP4CHRM2DRD1
SCHEMBL11324091 0.83 LMNA (0.61) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL10873725 0.83 DPP4 (0.40) LMNAKDM4EHSD17B10DPP4CHRM2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0187376-A2 6,7-Disubstituted 1-cyclopropyl-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acids BAYER AG (DE) 1986-07-16 EP claimed
EP-0187376-B1 6,7-DISUBSTITUTED 1-CYCLOPROPYL-1,4-DIHYDRO-4-OXO-1,8-NAPHTHYRIDINE-3-CARBOXYLIC ACIDS BAYER AG (DE) 1992-05-13 EP disclosed
EP-0187376-A2 6,7-Disubstituted 1-cyclopropyl-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acids BAYER AG (DE) 1986-07-16 EP disclosed