SCHEMBL7423010

SCHEMBL7423010

Nc1ccc(C(=O)NC2CN3CCC2CC3)c2c1CC1(CCCCC1)O2

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 1/20 0.45

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
SCHEMBL7416260 0.84 HTR3A (0.46) HTR3A
SCHEMBL7419563 0.84 HTR3A (0.54) HTR3A
SCHEMBL7418695 0.83 HTR3A (0.49) HTR3A
SCHEMBL7416784 0.83 HTR3A (0.55) HTR3A
SCHEMBL7413463 0.77 HTR3A (0.64) HTR3A
SCHEMBL7415240 0.77 HTR3A (0.48) HTR3A
SCHEMBL7419706 0.77 HTR3A (0.64) HTR3A
SCHEMBL7413930 0.77 HTR3A (0.64) HTR3A
SCHEMBL7416644 0.77 HTR3A (0.64) HTR3A
SCHEMBL7409421 0.76 HTR3A (0.65) HTR3A

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
WO-1991016888-A1 SPIRO[BENZOFURANCYCLOALKANE]CARBOXAMIDES AS 5HT3 ANTAGONISTS RHONE-POULENC RORER INTERNATIONAL (HOLDINGS), INC. (US) 1991-11-14 WO claimed
WO-1991016888-A1 SPIRO[BENZOFURANCYCLOALKANE]CARBOXAMIDES AS 5HT3 ANTAGONISTS RHONE-POULENC RORER INTERNATIONAL (HOLDINGS), INC. (US) 1991-11-14 WO disclosed