SCHEMBL7958751

SCHEMBL7958751

COc1cccc2c1ccn2CCOC(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.53
PRMT5 O14744 1/20 0.44
HTR6 P50406 1/20 0.43
SIGMAR1 Q99720 2/20 0.43
HTR1A P08908 1/20 0.42
ADRA1D P25100 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42
P2RX7 Q99572 1/20 0.41
DUT P33316 1/20 0.41

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
SCHEMBL7948724 0.82 MCL1 (0.55) HTR6
SCHEMBL7960415 0.82 HTR2C (0.51) HTR2CSIGMAR1DUT
SCHEMBL12543673 0.81 HTR2C (0.60) HTR2CPRMT5HTR6
SCHEMBL7959260 0.81 HTR2C (0.54) HTR2CPRMT5HTR6SIGMAR1P2RX7
SCHEMBL7958454 0.75 HTR2C (0.60) HTR2CPRMT5HTR6
SCHEMBL6775018 0.74 HTR6 (0.61) HTR2CPRMT5HTR6P2RX7
SCHEMBL12542708 0.74 HTR2C (0.58) HTR2CPRMT5HTR6
SCHEMBL13228252 0.73 HTR2C (0.65) HTR2CPRMT5HTR6
SCHEMBL23927902 0.72 HTR2C (0.64) HTR2CPRMT5HTR6
Ethane SCHEMBL7937068 0.72 HTR6 (0.60) HTR2CPRMT5HTR6P2RX7

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
US-6323235-B1 CARDIOVASCULAR DISORDERS, ANTIISCHEMIC AGENTS AND ENZYME INHIBITORS OHTAKE ATSUSHI (JP) 2001-11-27 US disclosed
US-6043264-A A THROMBOXANE A2 RECEPTOR ANTAGONIST FOR TREATING HYPERTENSION, THROMBOSIS, ISCHEMIC HEART DISEASES, CIRCULATORY DISEASES, ARTERIOSCLEROSIS, PLATELET FUNCTION DISORDER, HYPERLIPIDEMIA, NEPHRITIS OR ASTHMA TORAY INDUSTRIES, INC. (JP) 2000-03-28 US disclosed
EP-0751126-A1 BENZENE-FUSED HETEROCYCLIC DERIVATIVE AND USE OF THE SAME TORAY INDUSTRIES, INC. (JP) 1997-01-02 EP disclosed