SCHEMBL7724234

SCHEMBL7724234

Cc1ccccc1C(C(=O)N[C@H]1CCN(CCc2ccc(F)cc2)C1)c1ccccc1C

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.45
DRD4 P21917 1/20 0.45
SIGMAR1 Q99720 3/20 0.45
HTR7 P34969 2/20 0.45
HTR2A P28223 2/20 0.45
HTR2C P28335 2/20 0.45
HTR6 P50406 1/20 0.45
TMEM97 Q5BJF2 2/20 0.44
OPRM1 P35372 1/20 0.44
HTR1A P08908 1/20 0.43
CCR3 P51677 1/20 0.43
ADRA2B P18089 1/20 0.43
DRD1 P21728 1/20 0.43
HRH1 P35367 1/20 0.43
ADRA1B P35368 1/20 0.43
OPRK1 P41145 1/20 0.43
HTR2B P41595 1/20 0.43
KCNQ1 P51787 1/20 0.43
KCNH2 Q12809 1/20 0.43

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
SCHEMBL7724237 1.00 DRD2 (0.45) DRD2DRD4SIGMAR1HTR7HTR2A
SCHEMBL7729407 0.90 SIGMAR1 (0.48) DRD2DRD4SIGMAR1HTR7HTR2A
SCHEMBL7729412 0.90 SIGMAR1 (0.48) DRD2DRD4SIGMAR1HTR7HTR2A
SCHEMBL7729521 0.81 DRD2 (0.45) DRD2DRD4SIGMAR1HTR7HTR2A
SCHEMBL7729514 0.81 DRD2 (0.45) DRD2DRD4SIGMAR1HTR7HTR2A
SCHEMBL7723172 0.80 HTR2A (0.52) DRD2DRD4SIGMAR1HTR7HTR2A
SCHEMBL7723166 0.80 HTR2A (0.52) DRD2DRD4SIGMAR1HTR7HTR2A
SCHEMBL7724283 0.78 CCR3 (0.50) DRD2DRD4HTR7HTR2AHTR2C
SCHEMBL7724290 0.78 CCR3 (0.50) DRD2DRD4HTR7HTR2AHTR2C
SCHEMBL7729558 0.77 CCR1 (0.60) DRD4SIGMAR1HTR2AHTR2C

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