SCHEMBL9442736

SCHEMBL9442736

CCOC(=O)c1cn(CC)c2c(F)c(C3CC3)c(F)cc2c1=O

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.52
KDM4E B2RXH2 5/20 0.52
ALDH1A1 P00352 5/20 0.52
HSD17B10 Q99714 5/20 0.52
KMT2A Q03164 2/20 0.50
TDP1 Q9NUW8 1/20 0.49
STAT3 P40763 2/20 0.48
ADRB2 P07550 1/20 0.48
POLB P06746 1/20 0.48
LMNA P02545 1/20 0.47
PMP22 Q01453 1/20 0.46
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
HTT P42858 2/20 0.41
CYP1A2 P05177 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
SCHEMBL9442737 0.87 KDM4E (0.59) HPGDKDM4EALDH1A1HSD17B10KMT2A
SCHEMBL29895231 0.86 STAT3 (0.61) HPGDKDM4EALDH1A1HSD17B10KMT2A
SCHEMBL6756451 0.86 STAT3 (0.61) HPGDKDM4EALDH1A1HSD17B10KMT2A
SCHEMBL9442745 0.85 HPGD (0.48) HPGDKDM4EALDH1A1HSD17B10KMT2A
SCHEMBL11229199 0.84 KMT2A (0.56) HPGDKDM4EALDH1A1HSD17B10KMT2A
SCHEMBL10574238 0.84 KDM4E (0.55) HPGDKDM4EALDH1A1HSD17B10KMT2A
SCHEMBL9442768 0.84 KMT2A (0.48) HPGDKDM4EALDH1A1HSD17B10KMT2A
SCHEMBL9442764 0.83 LMNA (0.58) HPGDKDM4EALDH1A1HSD17B10KMT2A
SCHEMBL10459763 0.82 STAT3 (0.56) HPGDKDM4EALDH1A1HSD17B10KMT2A
SCHEMBL10623495 0.81 KMT2A (0.55) HPGDKDM4EALDH1A1HSD17B10KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5233091-A Cyclopropyl fluoroaniline as chemical intermediate for bactericides PFIZER INC. (US) 1993-08-03 US disclosed
US-5104868-A Bactericides PFIZER INC. (US) 1992-04-14 US disclosed
US-5103040-A Bactericides PFIZER INC. (US) 1992-04-07 US disclosed
US-5039682-A Bactericides PFIZER INC. (US) 1991-08-13 US disclosed
EP-0348088-A1 6-Fluoro-1,4-dihydroquinol-4-one-3-carboxylic acid derivatives and intermediates therefor PFIZER INC. (US) 1989-12-27 EP disclosed