SCHEMBL7719803

SCHEMBL7719803

O=C(N[C@H]1CCN(CCc2ccc(F)cc2)C1)C1C2=CC=C1CC2

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 4/20 0.51
DRD2 P14416 2/20 0.49
DRD4 P21917 2/20 0.49
HTR2A P28223 4/20 0.49
HTR2C P28335 3/20 0.49
HTR7 P34969 3/20 0.49
HTR6 P50406 2/20 0.49
SIGMAR1 Q99720 3/20 0.46
SLC6A12 P48065 1/20 0.46
TMEM97 Q5BJF2 1/20 0.46
MCHR1 Q99705 1/20 0.46
CACNA1G O43497 1/20 0.44
PRKAA2 P54646 1/20 0.44

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
SCHEMBL7724256 0.88 SIGMAR1 (0.57) DRD2DRD4HTR2ASIGMAR1MCHR1
SCHEMBL7729553 0.82 HTR2A (0.52) CCR3DRD2DRD4HTR2AHTR2C
SCHEMBL7729559 0.82 HTR2A (0.52) CCR3DRD2DRD4HTR2AHTR2C
SCHEMBL7719806 0.81 HTR2A (0.51) CCR3DRD2DRD4HTR2AHTR2C
SCHEMBL7729551 0.81 HTR2A (0.51) CCR3DRD2DRD4HTR2AHTR2C
SCHEMBL7723289 0.81 C3AR1 (0.50) CCR3DRD2DRD4HTR2AHTR2C
SCHEMBL7723287 0.81 C3AR1 (0.50) CCR3DRD2DRD4HTR2AHTR2C
SCHEMBL7724223 0.80 CCR1 (0.58) CCR3DRD2DRD4HTR2AHTR2C
SCHEMBL7729771 0.80 DRD2 (0.48) CCR3DRD2DRD4HTR2AHTR2C
SCHEMBL7724221 0.80 CCR1 (0.58) CCR3DRD2DRD4HTR2AHTR2C

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-6468998-B1 ANTAGONIZE SEROTONIN 2 RECEPTORS, SUPPRESS PLATELET AGGREGATION, IMPROVE PERIPHERAL CIRCULATION AND PROMOTE LACHRYMATION MITSUBISHI PHARMA CORPORATION (JP) 2002-10-22 US disclosed
EP-1125922-A1 PYRROLIDINE COMPOUNDS AND MEDICINAL UTILIZATION THEREOF Welfide Corporation (JP) 2001-08-22 EP disclosed