SCHEMBL9775972

SCHEMBL9775972

CCOC(=O)c1cn(C(C)(C)C)c2nc3c(F)c(N4CCNCC4)c(F)cc3cc2c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
CYP2C9 P11712 1/20 0.42
ATP6V1B2 P21281 1/20 0.42
TBXA2R P21731 1/20 0.42
EDNRA P25101 1/20 0.42
TARBP2 Q15633 1/20 0.42
DYRK1A Q13627 1/20 0.41
ALDH1A1 P00352 6/20 0.40
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 6/20 0.39
HPGD P15428 6/20 0.39
HSD17B10 Q99714 5/20 0.39
STAT3 P40763 2/20 0.37
CYP2C19 P33261 1/20 0.36
MEN1 O00255 1/20 0.36
BRD4 O60885 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
CYP2J2 P51589 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL9775898 0.89 LMNA (0.44) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9775904 0.88 LMNA (0.56) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9776101 0.88 LMNA (0.50) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9775877 0.86 ADRB2 (0.43) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9775927 0.86 LMNA (0.42) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9775866 0.86 STAT3 (0.43) LMNAALDH1A1KMT2AKDM4EHPGD
SCHEMBL9775892 0.85 LMNA (0.53) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9684577 0.84 LMNA (0.59) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9686413 0.84 STAT3 (0.47) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9786183 0.79 KMT2A (0.42) ALDH1A1KMT2AKDM4EHPGDHSD17B10

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
US-5004745-A Benzo[1,8]naphthyridine derivatives, their preparation and the compositions which contain them LABORATOIRE ROGER BELLON (FR) 1991-04-02 US disclosed
US-4970213-A Benzo(1,8)naphthyridine derivatives as intermediates RHONE-POULENC SANTE (FR) 1990-11-13 US disclosed