SCHEMBL9018901

SCHEMBL9018901

NC(=O)N(/N=C(/Cc1ccc(F)cc1)c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.42
POLQ O75417 2/20 0.40
VNN1 O95497 1/20 0.40
MAOB P27338 1/20 0.39
CYP1A1 P04798 1/20 0.38
CYP1B1 Q16678 1/20 0.38
PRKAB2 O43741 1/20 0.37
PRKAG1 P54619 1/20 0.37
PRKAA2 P54646 1/20 0.37
PRKAA1 Q13131 1/20 0.37
PRKAG3 Q9UGI9 1/20 0.37
PRKAG2 Q9UGJ0 1/20 0.37
PRKAB1 Q9Y478 1/20 0.37
SRD5A2 P31213 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPK8 P45983 1/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36

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
SCHEMBL9018845 0.82 VNN1 (0.39) VNN1MAOBGRIN2B
SCHEMBL9018853 0.80 BCL2A1 (0.39) CYP3A4
SCHEMBL9508158 0.77 GRIN2B (0.47) GRIN2B
SCHEMBL9419947 0.76 PAX8 (0.49) PAX8VNN1MAOBCYP1A1CYP1B1
SCHEMBL1121810 0.73 SERPINE1 (0.37) VNN1MAOB
SCHEMBL6339735 0.72 PTPN1 (0.56) VNN1CYP1A1CYP1B1SRD5A2CES2
SCHEMBL9018882 0.70 L3MBTL1 (0.47) CYP3A4CES2CES1GRIN2B
SCHEMBL9018902 0.69 EPHX2 (0.52) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL1567951 0.66 CA2 (0.57) MAOBSRD5A2MAPK8CES2CES1
SCHEMBL4847457 0.65 PTPN1 (0.63) MAOBSRD5A2CES2CES1PIK3CA

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-0462456-B1 Hydrazinecarboxamide derivatives, a process for production thereof, and uses thereof NIHON NOHYAKU CO LTD (JP) 1996-05-08 EP disclosed
EP-0462456-A1 Hydrazinecarboxamide derivatives, a process for production thereof, and uses thereof NIHON NOHYAKU CO., LTD. (JP) 1991-12-27 EP disclosed