SCHEMBL27641815

SCHEMBL27641815

CC(=O)N(F)c1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.45
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 3/20 0.43
POLB P06746 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MT-CO2 P00403 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
FSCN1 Q16658 1/20 0.40
ALOX15 P16050 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
BRD4 O60885 1/20 0.39
CES2 O00748 2/20 0.39
CES1 P23141 2/20 0.39
ENPP2 Q13822 1/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 2/20 0.38
HSD17B10 Q99714 2/20 0.38
HPGD P15428 1/20 0.38
MMP2 P08253 1/20 0.37

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
SCHEMBL27662343 0.80 TSHR (0.42) ALDH1A1POLBMEN1KMT2ACES2
SCHEMBL9835405 0.80 CES2 (0.41) LMNAKDM4EALDH1A1POLBTDP1
SCHEMBL27662346 0.78 CYP1A2 (0.39) LMNAKDM4EALDH1A1CES2CES1
SCHEMBL27616188 0.78 CYP3A4 (0.44) LMNAKDM4EALDH1A1TDP1ALOX15
SCHEMBL1635424 0.77 NPSR1 (0.46) ALDH1A1POLBNPSR1MEN1KMT2A
SCHEMBL28763259 0.77 MT-CO2 (0.57) LMNAKDM4EALDH1A1POLBTDP1
SCHEMBL10780259 0.77 LMNA (0.47) LMNAKDM4EALDH1A1POLBTDP1
SCHEMBL28760865 0.76 HTR3E (0.46) LMNAALDH1A1FSCN1MEN1KMT2A
SCHEMBL17671229 0.76 ALOX15 (0.50) LMNAKDM4EALDH1A1POLBTDP1
SCHEMBL3150016 0.76 LMNA (0.46) LMNAKDM4EALDH1A1POLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101270097-B Process for production of 1-aryl-5-(trifluoromethyl)-1H-tetrazoles TOYO BOSEKI 2011-04-13 CN disclosed
CN-100424069-C Preparation method of N-aryl-2, 2, 2-trifluoro acetimidoyl chloride TOYO KASEI KOGYO CO LTD (JP) 2008-10-08 CN disclosed
CN-101270097-A Process for production of 1-aryl-5-(trifluoromethyl)-1H-tetrazoles TOYO KASEI KOGYO CO LTD (JP) 2008-09-24 CN disclosed
CN-1863765-A Preparation method of 1-aryl-5- (trifluoromethyl) -1H-tetrazole TOYO KASEI KOGYO CO LTD (JP) 2006-11-15 CN disclosed