SCHEMBL8502010

SCHEMBL8502010

CC(C)Oc1cccc(-n2c(N)nc3ccccc3c2=O)c1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.56
CCKBR P32239 1/20 0.56

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
SCHEMBL8503645 0.85 SMN1; SMN2 (0.56) SMN1; SMN2CCKBR
SCHEMBL6308294 0.85 CCKBR (0.63) CCKBR
SCHEMBL27810320 0.80 KDM4E (0.62) SMN1; SMN2
SCHEMBL16620509 0.76 HIF1A (0.60) CCKBR
SCHEMBL29175100 0.76 ALDH1A1 (0.70) SMN1; SMN2
SCHEMBL9092956 0.74 CCKBR (0.45) CCKBR
SCHEMBL1553134 0.74 SMN1; SMN2 (0.63) SMN1; SMN2
SCHEMBL29175098 0.73 SMN1; SMN2 (0.66) SMN1; SMN2
SCHEMBL9953795 0.72 SMN1; SMN2 (0.55) SMN1; SMN2
SCHEMBL10289024 0.72 SMN1; SMN2 (0.55) SMN1; SMN2CCKBR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5869665-A REACTING 2-HYDRAZINE PRECURSOR WITH HYDROGEN; CYCLIZATION WARNER-LAMBERT COMPANY (US) 1999-02-09 US disclosed
US-5756502-A APPETITE SUPPRESSANTS AND ANTISECRETORY AGENTS WARNER-LAMBERT COMPANY (US) 1998-05-26 US disclosed