SCHEMBL11082099

SCHEMBL11082099

CN1CC(c2c(Cl)cccc2Cl)CN=C1N

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.38
HTR5A P47898 4/20 0.38
HTR1A P08908 3/20 0.38
HTR7 P34969 3/20 0.38
HTR1D P28221 2/20 0.38
HTR2A P28223 2/20 0.38
HTR3A P46098 1/20 0.38
HTR6 P50406 1/20 0.38
HRH1 P35367 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.34
PRMT5 O14744 1/20 0.34
HTR2B P41595 1/20 0.34
ACHE P22303 1/20 0.32
SRD5A1 P18405 1/20 0.32
BRD4 O60885 1/20 0.32

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
SCHEMBL11083189 0.83 ADRA1A (0.40) HTR1AHTR6BRD4
SCHEMBL11087057 0.81 ABCB1 (0.35) HTR2CHTR2BBRD4
SCHEMBL11082401 0.78 DPP4 (0.39) HTR2CHTR2AHTR2BACHE
SCHEMBL11078137 0.78 SLC6A2 (0.41) ACHE
SCHEMBL11084048 0.77
SCHEMBL11086369 0.77 BRD4 (0.32) SRD5A1BRD4
SCHEMBL11090881 0.76 SRD5A1 (0.53) SRD5A1BRD4
SCHEMBL11072826 0.76 BRD4 (0.53) HTR2AHRH1SRD5A1BRD4
SCHEMBL11085800 0.73 SRD5A1 (0.36) SRD5A1
SCHEMBL11087338 0.73 DRD2 (0.44) HTR2CHTR2AHTR2BBRD4

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
EP-0024776-B1 4-PHENYL AND 5-PHENYL-1,4,5,6-TETRAHYDROPYRIMIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING SAID DERIVATIVES, AND PROCESS FOR PREPARING SAID DERIVATIVES SYNTEX (U.S.A.) INC. (US) 1984-12-27 EP disclosed
EP-0024776-A1 4-Phenyl and 5-phenyl-1,4,5,6-tetrahydropyrimidine derivatives, pharmaceutical compositions containing said derivatives, and process for preparing said derivatives SYNTEX (U.S.A.) INC. (US) 1981-03-11 EP disclosed