SCHEMBL8192196

SCHEMBL8192196

O=C(c1cccs1)c1c[nH]nc1-c1ccc(Cl)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CCNB2 O95067 1/20 0.42
CCNE2 O96020 1/20 0.42
CDK1 P06493 1/20 0.42
CCNB1 P14635 1/20 0.42
CCNE1 P24864 1/20 0.42
CDK2 P24941 1/20 0.42
CCNB3 Q8WWL7 1/20 0.42
CYP2C9 P11712 1/20 0.41
RORB Q92753 1/20 0.40
LMNA P02545 2/20 0.40
ALOX15 P16050 2/20 0.40
HSP90AA1 P07900 1/20 0.39
KMT2A Q03164 1/20 0.39
CNR2 P34972 2/20 0.39
HSD17B10 Q99714 2/20 0.38
MAPK1 P28482 1/20 0.38
PSMD14 O00487 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL8190570 0.76 MAPT (0.42) MAPTSMN1; SMN2RORBLMNAALOX15
SCHEMBL29463149 0.73 LMNA (0.50) MAPTCCNB2CCNE2CDK1CCNB1
SCHEMBL523863 0.72 MAPT (0.49) MAPTSMN1; SMN2CCNB2CCNE2CDK1
SCHEMBL8194073 0.68 MAPT (0.48) MAPTSMN1; SMN2LMNAALOX15KMT2A
SCHEMBL24105612 0.66 ALOX15 (0.49) MAPTSMN1; SMN2CYP2C9LMNAALOX15
SCHEMBL30421622 0.66 TP53 (0.66) MAPTCYP2C9RORBLMNAALOX15
SCHEMBL9821675 0.66 TP53 (0.66) MAPTCYP2C9RORBLMNAALOX15
SCHEMBL15012670 0.66 RORB (0.48) RORBNOTUM
SCHEMBL23294452 0.66 KMO (0.47) IDO1KMO
SCHEMBL11755917 0.66 SMN1; SMN2 (0.68) MAPTSMN1; SMN2CYP2C9LMNAALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6030926-A AS HERBICIDE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2000-02-29 US disclosed
US-5939559-A HERBICIDES FROM PYRAZOLE KETONES NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1999-08-17 US disclosed
EP-0822187-A1 PYRAZOLE DERIVATIVES AND HERBICIDES NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1998-02-04 EP disclosed