SCHEMBL7304751

SCHEMBL7304751

COC(CN)Cc1ncc[nH]1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 10/20 0.37
ALOX15 P16050 1/20 0.37
HTR1A P08908 1/20 0.35
TERT O14746 1/20 0.34
FDPS P14324 1/20 0.33
TXN P10599 1/20 0.33
TXNRD1 Q16881 1/20 0.33
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TBXAS1 P24557 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
SCHEMBL6013494 0.78 ALOX15 (0.41) TAAR1ALOX15HTR1ATERTFDPS
SCHEMBL7274747 0.77 TAAR1 (0.47) TAAR1ALOX15HTR1ATERTTXN
SCHEMBL1970139 0.74 ALOX15 (0.41) TAAR1ALOX15HTR1ATERTFDPS
SCHEMBL1971765 0.74 ALOX15 (0.41) TAAR1ALOX15HTR1ATERTFDPS
Hydrochloric Acid SCHEMBL3949887 0.73 ALOX15 (0.40) TAAR1ALOX15HTR1ATERTFDPS
SCHEMBL1665687 0.72
SCHEMBL233107 0.71
SCHEMBL4775871 0.71 ALOX15 (0.45) TAAR1ALOX15HTR1ATERTFDPS
SCHEMBL10654795 0.71
SCHEMBL18457197 0.70 FDPS (0.37) TAAR1ALOX15HTR1ATERTFDPS

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-5081131-A Omega-((hetero)alkyl)benz(cd)-indol-2-amines AMERICAN CYANAMID COMPANY (US) 1992-01-14 US disclosed
EP-0230035-A2 Omega-[(hetero)alkyl]benz[cd]indol-2-amines AMERICAN CYANAMID COMPANY (US) 1987-07-29 EP disclosed