SCHEMBL8942010

SCHEMBL8942010

Cn1cc(C(=O)O)c(=O)c2cc3cc(F)c(N4CC(C)(N)C4)c(F)c3nc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.41
KCNH2 Q12809 2/20 0.40
CYP2C9 P11712 2/20 0.37
LMNA P02545 1/20 0.37
ATP6V1B2 P21281 1/20 0.37
TBXA2R P21731 1/20 0.37
EDNRA P25101 1/20 0.37
TARBP2 Q15633 1/20 0.37
HPGD P15428 6/20 0.35
HSD17B10 Q99714 6/20 0.35
ALDH1A1 P00352 5/20 0.35
ADRA2B P18089 1/20 0.35
MAPK1 P28482 1/20 0.35
PMP22 Q01453 1/20 0.35
DPP4 P27487 2/20 0.35
EPHA2 P29317 1/20 0.35
FLT4 P35916 1/20 0.35
GSK3B P49841 1/20 0.35
RARB P10826 1/20 0.35
TBXAS1 P24557 1/20 0.35

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
SCHEMBL8942189 0.88 HPGD (0.38) KDM4EKCNH2CYP2C9LMNAATP6V1B2
SCHEMBL8941908 0.88 KDM4E (0.37) KDM4EKCNH2CYP2C9LMNAATP6V1B2
SCHEMBL8942056 0.88 KDM4E (0.37) KDM4EKCNH2CYP2C9LMNAATP6V1B2
SCHEMBL8941894 0.88 LMNA (0.52) KDM4EKCNH2CYP2C9LMNAATP6V1B2
SCHEMBL8942245 0.87 DPP4 (0.49) KDM4EKCNH2LMNAHSD17B10ALDH1A1
SCHEMBL9527325 0.85 KDM4E (0.57) KDM4ECYP2C9LMNAATP6V1B2TBXA2R
SCHEMBL9786232 0.84 KDM4E (0.48) KDM4ECYP2C9LMNAATP6V1B2TBXA2R
SCHEMBL9775884 0.83 LMNA (0.52) KDM4ECYP2C9LMNAATP6V1B2TBXA2R
SCHEMBL8941910 0.82 KDM4E (0.40) KDM4EKCNH2CYP2C9LMNAATP6V1B2
SCHEMBL8941958 0.82 ALDH1A1 (0.39) KDM4EKCNH2CYP2C9LMNAATP6V1B2

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-5556861-A 1,8 benzonaphthyridine derivatives and antimicrobial compositions LABORATOIRE ROGER BELLON (FR) 1996-09-17 US disclosed