SCHEMBL9635375

SCHEMBL9635375

CCOC(=O)c1cn(CCF)c2c(F)c(N3CCNCC3)c(F)cc2c1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.62
HPGD P15428 6/20 0.52
ALDH1A1 P00352 6/20 0.52
HSD17B10 Q99714 5/20 0.52
PMP22 Q01453 1/20 0.51
STAT3 P40763 2/20 0.49
LMNA P02545 2/20 0.46
BRD4 O60885 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
CYP2J2 P51589 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
KMT2A Q03164 3/20 0.46
CYP2C9 P11712 1/20 0.45
ATP6V1B2 P21281 1/20 0.45
TBXA2R P21731 1/20 0.45
EDNRA P25101 1/20 0.45
TARBP2 Q15633 1/20 0.45
MEN1 O00255 1/20 0.43
CYP2C19 P33261 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
SCHEMBL11182877 0.93 KDM4E (0.53) KDM4EHPGDALDH1A1HSD17B10PMP22
SCHEMBL9636784 0.90 KDM4E (0.76) KDM4EHPGDALDH1A1HSD17B10PMP22
SCHEMBL9635338 0.89 KDM4E (0.58) KDM4EHPGDALDH1A1HSD17B10PMP22
SCHEMBL6305606 0.87 KDM4E (0.80) KDM4EHPGDALDH1A1HSD17B10PMP22
Hydrochloric Acid SCHEMBL10739298 0.86 KDM4E (0.79) KDM4EHPGDALDH1A1HSD17B10PMP22
SCHEMBL9686413 0.85 STAT3 (0.47) KDM4EHPGDALDH1A1HSD17B10PMP22
SCHEMBL5258333 0.84 STAT3 (0.62) KDM4EHPGDALDH1A1HSD17B10STAT3
SCHEMBL6776958 0.84 ADRB2 (0.59) KDM4EHPGDALDH1A1HSD17B10PMP22
SCHEMBL9633508 0.83 KDM4E (0.58) KDM4EHPGDALDH1A1HSD17B10PMP22
SCHEMBL11235862 0.82 STAT3 (0.54) KDM4EHPGDALDH1A1HSD17B10STAT3

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-0195135-B1 A PROCESS FOR THE PREPARATION OF QUINOLINE CARBOXYLIC ACID DERIVATIVES KYORIN SEIYAKU KABUSHIKI KAISHA (JP) 1992-06-17 EP disclosed
EP-0195135-A1 A process for the preparation of quinoline carboxylic acid derivatives KYORIN SEIYAKU KABUSHIKI KAISHA (JP) 1986-09-24 EP disclosed