SCHEMBL7298673

SCHEMBL7298673

COc1ccc2c(c1)c(=O)[nH]c(=O)n2CCCCN1CCN(c2ccccc2Cl)CC1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.56
DRD2 P14416 4/20 0.56
ADRA1D P25100 3/20 0.56
ADRA1A P35348 3/20 0.56
ADRA1B P35368 3/20 0.56
DRD1 P21728 2/20 0.56
HTR7 P34969 6/20 0.55
HTR2A P28223 1/20 0.53
KDM4E B2RXH2 1/20 0.47
LMNA P02545 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
SCHEMBL7309594 0.91 HTR7 (0.68) HTR1ADRD2ADRA1DADRA1AADRA1B
SCHEMBL7306583 0.85 HTR1A (0.70) HTR1ADRD2ADRA1AADRA1BHTR7
SCHEMBL7312723 0.81 HTR1A (0.57) HTR1ADRD2ADRA1DADRA1AADRA1B
SCHEMBL7300518 0.79 HTR7 (0.77) HTR1ADRD2HTR7HTR2A
SCHEMBL7300725 0.79 HTR7 (0.67) HTR1ADRD2ADRA1DADRA1AADRA1B
SCHEMBL7298112 0.78 MAOA (0.46) KDM4E
SCHEMBL8943310 0.78 HTR7 (0.81) HTR1ADRD2HTR7
SCHEMBL7303980 0.77 PARP1 (0.60) HTR1AKDM4E
SCHEMBL8136027 0.76 HTR7 (0.72) HTR1AHTR7LMNA
SCHEMBL7310111 0.76 MAOA (0.46) KDM4ELMNA

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