SCHEMBL8941894

SCHEMBL8941894

CCn1cc(C(=O)O)c(=O)c2cc3cc(F)c(N4CC(C)(N)C4)c(F)c3nc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.52
CYP2C9 P11712 1/20 0.52
ATP6V1B2 P21281 1/20 0.52
TBXA2R P21731 1/20 0.52
EDNRA P25101 1/20 0.52
TARBP2 Q15633 1/20 0.52
KDM4E B2RXH2 7/20 0.45
HPGD P15428 6/20 0.45
HSD17B10 Q99714 5/20 0.45
ALDH1A1 P00352 5/20 0.45
PMP22 Q01453 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ABCC4 O15439 1/20 0.44
PKM P14618 1/20 0.44
PTGS1 P23219 1/20 0.44
CASP1 P29466 1/20 0.44
DRD3 P35462 1/20 0.41
TSHR P16473 2/20 0.41
HIF1A Q16665 1/20 0.41

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
SCHEMBL8942036 0.89 LMNA (0.48) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL8942010 0.88 KDM4E (0.41) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL8941908 0.85 KDM4E (0.37) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL8942056 0.85 KDM4E (0.37) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9776017 0.85 KDM4E (0.61) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL8942245 0.85 DPP4 (0.49) LMNAKDM4EHSD17B10ALDH1A1ABCC4
SCHEMBL9775882 0.84 LMNA (0.70) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL8942170 0.84 LMNA (0.50) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL8942023 0.83 LMNA (0.51) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9142705 0.83 LMNA (0.70) LMNACYP2C9ATP6V1B2TBXA2REDNRA

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