SCHEMBL3637618

SCHEMBL3637618

Nc1nc(N)c(-c2ccc(NCCc3ccncc3)cc2)c(COCc2ccccc2)n1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 20/20 0.81
▸ DHFR P00374 1/20 0.64

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
SCHEMBL3632090 0.90 GHSR (1.00) GHSRDHFR
SCHEMBL3633395 0.89 GHSR (0.81) GHSRDHFR
SCHEMBL3640256 0.85 GHSR (0.78) GHSRDHFR
SCHEMBL3637814 0.85 GHSR (0.83) GHSRDHFR
SCHEMBL3635041 0.84 GHSR (1.00) GHSRDHFR
SCHEMBL3634348 0.83 GHSR (0.81) GHSRDHFR
SCHEMBL3632177 0.83 GHSR (0.74) GHSRDHFR
SCHEMBL3638737 0.82 GHSR (0.73) GHSRDHFR
SCHEMBL3635615 0.82 GHSR (0.82) GHSRDHFR
SCHEMBL3636675 0.81 GHSR (0.85) GHSRDHFR

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
EP-2155227-A1 NEW TREATMENT FOR CHEMICAL SUBSTANCE ADDICTION Dickson, Suzanne L (SE) 2010-02-24 — — EP disclosed
WO-2009020419-A1 NEW TREATMENT FOR CHEMICAL SUBSTANCE ADDICTION DICKSON SUZANNE L (SE) 2009-02-12 — — WO disclosed
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