SCHEMBL5664178

SCHEMBL5664178

CCCCc1nnc2n1-c1sc3c(c1C(c1ccccc1Cl)=NC2)CCNC3

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 15/20 0.48
OPRK1 P41145 1/20 0.44
PDE4D Q08499 1/20 0.44
TBXAS1 P24557 2/20 0.38

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
SCHEMBL5666605 0.97 PTAFR (0.46) PTAFROPRK1PDE4DTBXAS1
SCHEMBL5664204 0.97 PTAFR (0.45) PTAFROPRK1PDE4DTBXAS1
SCHEMBL5663624 0.97 PTAFR (0.45) PTAFROPRK1PDE4DTBXAS1
SCHEMBL5664536 0.95 OPRK1 (0.45) PTAFROPRK1PDE4D
SCHEMBL5663627 0.92 OPRK1 (0.48) PTAFROPRK1PDE4DTBXAS1
SCHEMBL5664005 0.91 PTAFR (0.40) PTAFROPRK1PDE4DTBXAS1
SCHEMBL5663501 0.90 PTAFR (0.38) PTAFROPRK1PDE4DTBXAS1
SCHEMBL5664049 0.90 PTAFR (0.43) PTAFROPRK1PDE4D
SCHEMBL5664102 0.89 OPRK1 (0.42) PTAFROPRK1PDE4DTBXAS1
SCHEMBL5664306 0.89 PTAFR (0.43) PTAFROPRK1PDE4DTBXAS1

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-7015213-B1 Use of diazepines for preparing medicines for treating pathological conditions or diseases involving one of the growth hormone release inhibiting factor receptors SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2006-03-21 US claimed
US-7015213-B1 Use of diazepines for preparing medicines for treating pathological conditions or diseases involving one of the growth hormone release inhibiting factor receptors SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2006-03-21 US disclosed