SCHEMBL7295751

SCHEMBL7295751

Nc1ccccc1C(=O)NCCCCN1CC=C(c2ccc(F)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 7/20 0.57
SIGMAR1 Q99720 7/20 0.53
DRD2 P14416 1/20 0.49
DRD3 P35462 1/20 0.47

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
SCHEMBL7287704 0.92 HTR1A (0.54) HTR1ASIGMAR1DRD2DRD3
SCHEMBL7298721 0.91 HTR1A (0.56) HTR1ASIGMAR1DRD3
SCHEMBL7289555 0.90 HTR1A (0.57) HTR1ASIGMAR1DRD2DRD3
SCHEMBL7332019 0.80 HTR1A (0.53) HTR1ASIGMAR1DRD2DRD3
SCHEMBL7343150 0.80 HTR1A (0.53) HTR1ASIGMAR1DRD3
SCHEMBL7290257 0.80 HTR1A (0.56) HTR1ASIGMAR1DRD2DRD3
SCHEMBL7295734 0.79 MAPT (0.52) HTR1ASIGMAR1DRD3
SCHEMBL11827010 0.78 HTR1A (0.53) HTR1ASIGMAR1DRD2DRD3
SCHEMBL7292070 0.78 DRD3 (0.58) HTR1ASIGMAR1DRD2DRD3
SCHEMBL7298208 0.78 DRD3 (0.49) HTR1ASIGMAR1DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0436157-B1 Quinazoline derivatives and their preparation FUJISAWA PHARMACEUTICAL CO (JP) 1995-08-23 EP disclosed
US-5296487-A Dopamine antagonist for nervous system disorders FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-03-22 US disclosed
US-5264438-A Dopamine receptor agonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-11-23 US disclosed
EP-0436157-A1 Quinazoline derivatives and their preparation FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-07-10 EP disclosed