SCHEMBL7302539

SCHEMBL7302539

O=c1[nH]c(=O)n(CCCCCl)c2cc(Cl)ccc12

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 3/20 0.44
TYMP P19971 1/20 0.40
HTR7 P34969 2/20 0.39
PARP1 P09874 1/20 0.39
PGR P06401 1/20 0.39
HTR1A P08908 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
SCHEMBL7651696 0.88 MAT2A (0.44) MAT2ATYMPHTR7
SCHEMBL7309368 0.88 MAT2A (0.44) MAT2ATYMP
SCHEMBL7301671 0.83 MAT2A (0.48) MAT2ATYMP
SCHEMBL7305582 0.81 HTR1A (0.50) TYMPHTR7PARP1HTR1A
SCHEMBL7649804 0.80 HTR1A (0.49) TYMPHTR7PARP1HTR1A
SCHEMBL318631 0.80 DAO (0.55) HTR7PGRHTR1A
SCHEMBL7309296 0.77 TDP1 (0.47) MAT2A
SCHEMBL7312723 0.77 HTR1A (0.57) HTR7HTR1A
SCHEMBL7653099 0.77 HDAC1 (0.43) TYMP
SCHEMBL446902 0.77 PARP1 (0.50) PARP1PGRHTR1A

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-5304560-A Treating CNS disorders; dopamine receptor antagonist FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-04-19 US disclosed
EP-0481342-A1 Quinazoline derivatives and their preparation FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-04-22 EP disclosed