SCHEMBL7204980

SCHEMBL7204980

CC(Cc1c[nH]c2ccccc12)C(=O)NCC1(c2ccccn2)CCCCC1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 6/20 0.66
FPR1 P21462 5/20 0.66
NMBR P28336 10/20 0.59
GRPR P30550 9/20 0.59
AGTR1 P30556 1/20 0.54
GPR65 Q8IYL9 1/20 0.54
POLB P06746 1/20 0.51
CTDSP1 Q9GZU7 1/20 0.51

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
SCHEMBL7193483 0.82 FPR2 (0.54) FPR2FPR1NMBRGRPRAGTR1
SCHEMBL7849159 0.80 FPR2 (0.68) FPR2FPR1NMBRPOLBCTDSP1
SCHEMBL6250550 0.80 NMBR (0.71) FPR2FPR1NMBRGRPRAGTR1
SCHEMBL6250547 0.80 NMBR (0.71) FPR2FPR1NMBRGRPRAGTR1
SCHEMBL6810079 0.79 NMBR (0.58) FPR2FPR1NMBRGRPRAGTR1
SCHEMBL6252362 0.79 NMBR (0.57) FPR2FPR1NMBRGRPRAGTR1
SCHEMBL6250069 0.78 NMBR (0.73) FPR2FPR1NMBRGRPRAGTR1
SCHEMBL7138683 0.78 NMBR (0.66) FPR2FPR1NMBRGRPRAGTR1
SCHEMBL6250000 0.78 NMBR (0.70) FPR2FPR1NMBRGRPRAGTR1
SCHEMBL7678106 0.78 FPR2 (0.51) FPR2FPR1NMBRGRPRPOLB

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-1333824-A2 TREATMENT OF SEXUAL DYSFUNCTION Warner-Lambert Company LLC (US) 2003-08-13 EP disclosed
WO-2002040008-A2 TREATMENT OF SEXUAL DYSFUNCTION WITH NON PEPTIDE BOMBESIN RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY LLC (US) 2002-05-23 WO disclosed