SCHEMBL11808271

SCHEMBL11808271

CCOC(=O)/C(C#N)=C\N(C)c1cccc(C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.56
PDCD1 Q15116 1/20 0.53
CD274 Q9NZQ7 1/20 0.53
MAPT P10636 7/20 0.50
MIF P14174 1/20 0.49
DHODH Q02127 1/20 0.47
ALDH1A1 P00352 9/20 0.47
LMNA P02545 3/20 0.47
HPGD P15428 1/20 0.47
KDM4E B2RXH2 4/20 0.46
KMT2A Q03164 2/20 0.46
POLB P06746 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PTP4A1 Q93096 1/20 0.46
MEN1 O00255 1/20 0.46
PKM P14618 1/20 0.44
HTT P42858 1/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 2/20 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
SCHEMBL11808278 1.00 CYP2C9 (0.56) CYP2C9PDCD1CD274MAPTMIF
SCHEMBL11801924 0.88 CYP2C9 (0.53) CYP2C9PDCD1CD274MAPTMIF
SCHEMBL11801919 0.88 CYP2C9 (0.53) CYP2C9PDCD1CD274MAPTMIF
SCHEMBL10344918 0.87 CYP2C9 (0.61) CYP2C9PDCD1CD274MAPTMIF
SCHEMBL11804115 0.87 CYP2C9 (0.61) CYP2C9PDCD1CD274MAPTMIF
SCHEMBL11804382 0.79 CYP2C9 (0.57) CYP2C9PDCD1CD274MAPTMIF
SCHEMBL11804388 0.79 CYP2C9 (0.57) CYP2C9PDCD1CD274MAPTMIF
SCHEMBL11807501 0.77 CYP2C9 (0.58) CYP2C9PDCD1CD274MAPTMIF
SCHEMBL11807496 0.77 CYP2C9 (0.58) CYP2C9PDCD1CD274MAPTMIF
SCHEMBL21457418 0.76 MAPT (0.76) PDCD1CD274MAPTMIFALDH1A1

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-3981717-A ANILINO COMPOUNDS AMERICAN CYANAMID COMPANY (US) 1976-09-21 US claimed