SCHEMBL9834735

SCHEMBL9834735

CCCCN1C(=O)Cc2cccc(F)c21

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 4/20 0.46
DRD2 P14416 5/20 0.42
DRD3 P35462 4/20 0.42
CHRM2 P08172 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM5 P08912 1/20 0.42
CHRM3 P20309 1/20 0.42
DRD4 P21917 1/20 0.42
KCNH2 Q12809 1/20 0.39
HTR1A P08908 6/20 0.39
KDM4E B2RXH2 1/20 0.37
HTR7 P34969 9/20 0.36
MAPT P10636 1/20 0.36
DRD5 P21918 2/20 0.36
PTGS2 P35354 1/20 0.36
NOTUM Q6P988 1/20 0.36
CYP19A1 P11511 1/20 0.35

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
SCHEMBL5001527 0.84 CHRM1 (0.39) CHRM1HTR1AMAPTNOTUM
SCHEMBL4992293 0.83 CHRM1 (0.38) CHRM1DRD2KCNH2HTR1AHTR7
SCHEMBL5001522 0.76 BMPR1B (0.43) CHRM1HTR1AHTR7NOTUM
SCHEMBL7476444 0.75 DRD2 (0.63) CHRM1DRD2DRD3CHRM2CHRM4
SCHEMBL5506028 0.74 CHRM5 (0.48) CHRM1CHRM5HTR1AMAPT
SCHEMBL2008946 0.73 AADAT (0.40) CHRM1MAPTNOTUM
SCHEMBL11839322 0.73 KMT2A (0.64) CHRM1DRD2DRD3CHRM2CHRM4
SCHEMBL4236105 0.72 CHRM1 (0.53) CHRM1DRD2DRD3CHRM2CHRM4
SCHEMBL6439411 0.72 CHRM1 (0.70) CHRM1DRD2DRD3CHRM2CHRM4
Hydrochloric Acid SCHEMBL9096810 0.71 DRD2 (0.56) CHRM1DRD2DRD3CHRM2CHRM4

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
EP-0208510-B1 1-SUBSTITUTED OXINDOLE-3-CARBOXAMINES AS ANTIINFLAMMATORY AND ANALGESIC AGENTS PFIZER INC. (US) 1991-09-11 EP disclosed