SCHEMBL8987645

SCHEMBL8987645

CCc1nccc(N(C(C)=O)c2ccc(OCC(F)(F)F)cc2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PAX8 Q06710 1/20 0.37
BUB1 O43683 1/20 0.35
POLB P06746 2/20 0.34
ALDH1A1 P00352 2/20 0.34
CNR2 P34972 1/20 0.33
CYP2C9 P11712 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP17A1 P05093 1/20 0.33
CYP2C19 P33261 1/20 0.33
FADS1 O60427 1/20 0.33
SCN9A Q15858 1/20 0.32
KDM4E B2RXH2 1/20 0.32
RXRA P19793 1/20 0.32

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
SCHEMBL8988049 0.91 KDM4C (0.37) KDM4CSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL8987855 0.90 HTT (0.43) SMN1; SMN2MEN1KMT2ABUB1POLB
SCHEMBL8987741 0.89 KDM4C (0.36) KDM4CSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL8987991 0.89 KDM4C (0.37) KDM4CSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL8988022 0.87 MMP2 (0.38) KDM4CMEN1KMT2ABUB1SCN9A
SCHEMBL8987719 0.86 SMN1; SMN2 (0.39) KDM4CSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL8987887 0.85 TRPV1 (0.35) SMN1; SMN2LMNABUB1POLBALDH1A1
SCHEMBL8987845 0.85 LMNA (0.39) SMN1; SMN2NPC1LMNACYP2C9CYP1A2
SCHEMBL8987967 0.84 KDM4C (0.36) KDM4CSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL8988097 0.84 KDM4C (0.36) KDM4CSMN1; SMN2RAB9ANPC1LMNA

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
US-5556859-A N-(4-pyrimidinyl)amide pesticides DOWELANCO (US) 1996-09-17 US disclosed