SCHEMBL8961602

SCHEMBL8961602

Cc1cc(C=O)nc(Nc2ccccc2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.53
HTT P42858 2/20 0.53
SLC2A1 P11166 1/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
OGG1 O15527 1/20 0.48
USP2 O75604 1/20 0.47
POLB P06746 1/20 0.47
ALOX15 P16050 1/20 0.47
PTPN7 P35236 1/20 0.47
CREBBP Q92793 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 3/20 0.46
MAPT P10636 3/20 0.46
LMNA P02545 1/20 0.46
GPR55 Q9Y2T6 1/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL9795889 0.83 TAAR1 (0.55) TAAR1SMN1; SMN2HTTSLC2A1NPC1
SCHEMBL9795892 0.83 TAAR1 (0.55) TAAR1SMN1; SMN2HTTSLC2A1NPC1
Pyrimethanil SCHEMBL20817 0.82 SMN1; SMN2 (0.71) TAAR1SMN1; SMN2HTTSLC2A1NPC1
Pyrimethanil SCHEMBL10664468 0.81 SMN1; SMN2 (0.69) TAAR1SMN1; SMN2HTTSLC2A1NPC1
Pyrimethanil SCHEMBL22041985 0.81 SMN1; SMN2 (0.69) TAAR1SMN1; SMN2HTTSLC2A1NPC1
SCHEMBL9495890 0.79 TAAR1 (0.51) TAAR1SMN1; SMN2HTTSLC2A1NPC1
SCHEMBL9495894 0.79 TAAR1 (0.51) TAAR1SMN1; SMN2HTTSLC2A1NPC1
Pyrimethanil SCHEMBL28273473 0.77 SMN1; SMN2 (0.59) TAAR1SMN1; SMN2HTTSLC2A1NPC1
SCHEMBL12340074 0.76 MAPT (0.71) TAAR1SMN1; SMN2HTTSLC2A1NPC1
SCHEMBL8961597 0.76 SRC (0.40) USP2POLBKDM4EMAPTLMNA

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
EP-0457726-B1 2-Anilinopyrimidine derivatives as pesticides CIBA GEIGY AG (CH) 1996-02-07 EP disclosed
US-5439912-A Plant fungicide, insecticide, pesticide CIBA-GEIGY CORPORATION (US) 1995-08-08 US disclosed
EP-0457727-A1 Pesticides CIBA-GEIGY AG (CH) 1991-11-21 EP disclosed
EP-0457726-A1 2-Anilinopyrimidine derivatives as pesticides CIBA-GEIGY AG (CH) 1991-11-21 EP disclosed