SCHEMBL8327446

SCHEMBL8327446

COCCN(CCCN)Cc1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MCHR1 Q99705 1/20 0.43
MAPT P10636 1/20 0.41
TAAR1 Q96RJ0 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38

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
SCHEMBL8328677 0.85 MEN1 (0.43) MEN1KMT2AMCHR1MAPT
SCHEMBL8327315 0.81 DRD2 (0.41) MEN1KMT2AMCHR1
SCHEMBL14376647 0.81 MCHR1 (0.46) MEN1KMT2AMCHR1
Hydrochloric Acid SCHEMBL31687493 0.80 MAPT (0.45) MAPT
SCHEMBL713426 0.78 MAPT (0.55) MAPT
SCHEMBL3143360 0.75 MAPT (0.59) MEN1KMT2AMAPTCA2
SCHEMBL8326756 0.74 MAOB (0.59)
SCHEMBL6417812 0.74 CHRM2 (0.33) MEN1KMT2A
SCHEMBL11981474 0.73 MAPT (0.56) MAPTTAAR1
SCHEMBL11767 0.73 MAPT (0.52) MAPTTAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0760368-B1 PYRIMIDINE DERIVATIVES NISSHIN FLOUR MILLING CO (JP) 1999-07-28 EP disclosed
US-5736550-A TREATMENT OF GASTROINTESTINAL TRACT DISORDERS NISSHIN FLOUR MILLING CO., LTD. (JP) 1998-04-07 US disclosed
EP-0760368-A1 NOVEL PYRIMIDINE DERIVATIVE NISSHIN FLOUR MILLING CO., LTD. (JP) 1997-03-05 EP disclosed