SCHEMBL6566232

SCHEMBL6566232

CC(=O)c1nc2c(Oc3cccc(C(F)(F)F)c3)cccc2cc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
CYP1A2 P05177 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
RECQL P46063 1/20 0.45
ICAM1 P05362 1/20 0.43
SELE P16581 1/20 0.43
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GCGR P47871 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
USP2 O75604 1/20 0.39

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
SCHEMBL6565257 0.84 TTR (0.41) KDM4EKMT2A
SCHEMBL6564114 0.83 POLB (0.45) MAPTRECQLCYP3A4NPSR1L3MBTL1
SCHEMBL6567160 0.81 MAOB (0.47) MAPTL3MBTL1HTTKDM4EALDH1A1
SCHEMBL6566230 0.81 MAPT (0.46) MAPTCYP1A2CYP2C9CYP2C19RECQL
SCHEMBL6567173 0.76 LMNA (0.49) MAPTCYP1A2CYP2C9CYP2C19RECQL
SCHEMBL22719512 0.74 RXFP1 (0.57) MAPTCYP1A2CYP2C9CYP2C19RECQL
SCHEMBL6565243 0.73 MCHR1 (0.48) MAPTCYP1A2CYP2C9CYP2C19RECQL
SCHEMBL28737745 0.72 L3MBTL1 (0.47) MAPTCYP1A2CYP2C9CYP2C19RECQL
SCHEMBL8941708 0.72 AR (0.54) MAPTCYP1A2CYP2C9CYP2C19ICAM1
SCHEMBL6565264 0.70 MCHR1 (0.51) KMT2A

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
EP-0765871-B1 Substituted Quinoline-2-carboxamides, their preparation and their use as prolyle-4-hydroxylase Inhibitors FIBROGEN INC (US) 2004-03-31 EP disclosed
EP-0765871-A1 Substituted Quinoline-2-carboxamides, their preparation and their use as prolyle-4-hydroxylase Inhibitors HOECHST AKTIENGESELLSCHAFT (DE) 1997-04-02 EP disclosed