Pyrimethanil

Pyrimethanil

SCHEMBL22041985

Cc1cc(C)nc(Nc2ccccc2)n1.N

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.69
HTT P42858 2/20 0.69
TAAR1 Q96RJ0 1/20 0.69
RAB9A P51151 4/20 0.59
NPC1 O15118 3/20 0.59
MAPT P10636 4/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
NFKB1 P19838 1/20 0.59
MAPK1 P28482 1/20 0.59
USP2 O75604 1/20 0.56
POLB P06746 1/20 0.56
ALOX15 P16050 1/20 0.56
PTPN7 P35236 1/20 0.56
CREBBP Q92793 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
LMNA P02545 2/20 0.55
ALDH1A1 P00352 2/20 0.55
KDM4E B2RXH2 2/20 0.54
GPR55 Q9Y2T6 1/20 0.54

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
Pyrimethanil SCHEMBL20817 0.98 SMN1; SMN2 (0.71) SMN1; SMN2HTTTAAR1RAB9ANPC1
Pyrimethanil SCHEMBL10664468 0.96 SMN1; SMN2 (0.69) SMN1; SMN2HTTTAAR1RAB9ANPC1
Pyrimethanil SCHEMBL1467035 0.89 SMN1; SMN2 (0.61) SMN1; SMN2HTTTAAR1RAB9ANPC1
Pyrimethanil SCHEMBL28273473 0.87 SMN1; SMN2 (0.59) SMN1; SMN2HTTTAAR1RAB9ANPC1
SCHEMBL12340074 0.86 MAPT (0.71) SMN1; SMN2HTTTAAR1RAB9ANPC1
Pyrimethanil SCHEMBL22041969 0.86 SMN1; SMN2 (0.58) SMN1; SMN2HTTTAAR1RAB9ANPC1
Pyrimethanil SCHEMBL28097972 0.86 RAB9A (0.62) SMN1; SMN2HTTTAAR1RAB9ANPC1
SCHEMBL3708228 0.85 TAAR1 (0.61) SMN1; SMN2HTTTAAR1RAB9ANPC1
SCHEMBL29019057 0.85 SMN1; SMN2 (0.61) SMN1; SMN2HTTTAAR1RAB9ANPC1
SCHEMBL11410297 0.85 TAAR1 (0.61) SMN1; SMN2HTTTAAR1RAB9ANPC1

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
WO-2020133090-A1 PYRIDYLOXY THIOESTER DERIVATIVE AND PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION, AND APPLICATION 青岛清原化合物有限公司 2020-07-02 WO disclosed
WO-2020135236-A1 PYRIDYL OXYCARBOXYLIC ACID OXIME DERIVATIVE AND PREPARATION METHOD THEREFOR, WEEDING COMPOSITION AND APPLICATION THEREOF 青岛清原化合物有限公司 2020-07-02 WO disclosed
WO-2020133091-A1 PYRIDYLOXY CARBOXYLATE DERIVATIVE, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF 青岛清原化合物有限公司 2020-07-02 WO disclosed
WO-2020133092-A1 PYRIDYLOXY-CARBOXYLATE DERIVATIVE AND PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION, AND USE 青岛清原化合物有限公司 2020-07-02 WO disclosed
WO-2020114212-A1 4-(3-HETEROCYCLYL-1-BENZOYL) PYRAZOLE COMPOUND OR SALT THEREOF, PREPARATION METHOD THEREFOR, HERBICIDE COMPOSITION THEREOF AND USE THEREOF 青岛清原化合物有限公司 2020-06-11 WO disclosed