SCHEMBL8890115

SCHEMBL8890115

N#Cc1ccc(NC(=O)n2cccn2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.54
SAE1 Q9UBE0 1/20 0.49
UBA2 Q9UBT2 1/20 0.49
MAPT P10636 3/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 3/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
NLRP3 Q96P20 1/20 0.46
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
TAS1R2 Q8TE23 1/20 0.46
KDM4E B2RXH2 1/20 0.45
POLB P06746 1/20 0.45
PKM P14618 1/20 0.45
MAPK1 P28482 1/20 0.45
RAB9A P51151 1/20 0.45
IL18 Q14116 1/20 0.45

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
SCHEMBL8889350 0.84 IDO1 (0.46) NAMPTSAE1UBA2MAPTKMT2A
SCHEMBL19749 0.80 ELANE (0.47) ALDH1A1TSHRHTTKDM4EPOLB
SCHEMBL18993409 0.80 ELANE (0.41) NAMPTMAPTALDH1A1KDM4ERAB9A
SCHEMBL752964 0.77 NAMPT (0.48) NAMPTSAE1UBA2MAPTKMT2A
SCHEMBL18010125 0.76 AKR1C3 (0.39) NAMPTMAPTALDH1A1KDM4ERAB9A
SCHEMBL16692702 0.76 ELANE (0.38) NAMPTMAPTKMT2AMEN1ALDH1A1
SCHEMBL18184936 0.76 CYP19A1 (0.56) NAMPTSAE1UBA2MAPTKMT2A
SCHEMBL17276579 0.73 RAB9A (0.51) MAPTKMT2AMEN1ALDH1A1HTT
SCHEMBL15016132 0.72 RAB9A (0.54) NAMPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL3700860 0.71 NAMPT (0.58) NAMPTSAE1UBA2MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997003976-A1 SEMICARBAZONE DERIVATIVES AND PESTICIDES NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1997-02-06 WO disclosed