SCHEMBL9026522

SCHEMBL9026522

Cc1cnn(-c2ccncc2)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 5/20 0.40
CYP1A2 P05177 7/20 0.37
CYP17A1 P05093 5/20 0.37
CYP3A4 P08684 2/20 0.35
GAA P10253 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GSK3B P49841 1/20 0.35
RAB9A P51151 3/20 0.34
NPC1 O15118 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL23130664 0.82 ALDH1A1 (0.50) FLT3CYP1A2CYP3A4CYP2C19ALDH1A1
SCHEMBL9026138 0.82 RAB9A (0.49) CYP1A2GAACYP2C9ALDH1A1KMT2A
SCHEMBL9026151 0.80 GRM1 (0.46) CYP1A2CYP17A1CYP3A4ALDH1A1L3MBTL1
SCHEMBL12922837 0.80 MAPK1 (0.40) FLT3CYP1A2CYP17A1CYP3A4GAA
SCHEMBL19121077 0.79 ALDH1A1 (0.43) CYP1A2CYP17A1CYP2C9CYP2C19ALDH1A1
SCHEMBL19120598 0.79 NPBWR1 (0.49) CYP1A2ALDH1A1KMT2AL3MBTL1RAB9A
SCHEMBL25213729 0.77 GAA (0.41) FLT3CYP1A2CYP17A1CYP3A4GAA
SCHEMBL27681344 0.72 ALKBH1 (0.46) ALDH1A1KMT2AL3MBTL1RAB9ANPC1
SCHEMBL19119864 0.72 CYP3A4 (0.35) CYP1A2CYP17A1CYP3A4CYP2C19ALDH1A1
SCHEMBL10513861 0.71 ALDH1A1 (0.55) GAAALDH1A1KMT2ARAB9ANPC1

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
US-5220028-A Halogeno-4-methylpyrazoles NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1993-06-15 US claimed
EP-0366329-B1 Halogeno-4-methylpyrazoles and process for preparing the same NISSAN CHEMICAL IND LTD (JP) 1996-03-20 EP disclosed
US-5220028-A Halogeno-4-methylpyrazoles NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1993-06-15 US disclosed
EP-0366329-A1 Halogeno-4-methylpyrazoles and process for preparing the same NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1990-05-02 EP disclosed