SCHEMBL7294349

SCHEMBL7294349

NOCCCCn1ccnc1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 2/20 0.67
NOS1 P29475 3/20 0.55
LMNA P02545 3/20 0.55
KDM4E B2RXH2 1/20 0.55
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
TSHR P16473 1/20 0.53
MAPK1 P28482 2/20 0.51
USP2 O75604 1/20 0.51
ALOX15 P16050 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL7285990 0.94 TBXAS1 (0.63) TBXAS1NOS1KMT2AMEN1MAPK1
SCHEMBL15133511 0.86
SCHEMBL22268942 0.84 TBXAS1 (0.66) TBXAS1NOS1LMNAKDM4EKMT2A
SCHEMBL22268985 0.84 TBXAS1 (0.66) TBXAS1NOS1LMNAKDM4EKMT2A
SCHEMBL22268813 0.84 TBXAS1 (0.66) TBXAS1NOS1LMNAKDM4EKMT2A
SCHEMBL937596 0.83 TBXAS1 (0.95) TBXAS1
SCHEMBL1679410 0.81 TBXAS1 (1.00) TBXAS1
SCHEMBL10247600 0.81 TBXAS1 (1.00) TBXAS1
SCHEMBL2535103 0.81 TBXAS1 (1.00) TBXAS1
SCHEMBL939851 0.81 TBXAS1 (1.00) TBXAS1

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