SCHEMBL6155655

SCHEMBL6155655

O=C(O)c1ccc(N2C(=O)C3C4C=CC(CC4)C3C2=O)cc1

nearest known ligand 0.77

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.77
POLB P06746 1/20 0.68
CA1 P00915 3/20 0.58
CA12 O43570 2/20 0.58
CA9 Q16790 2/20 0.58
CA2 P00918 2/20 0.58
L3MBTL1 Q9Y468 2/20 0.51
ALDH1A1 P00352 1/20 0.51
ATM Q13315 2/20 0.50
MEN1 O00255 1/20 0.50
DDAH1 O94760 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
SCHEMBL3201443 0.90 KMT2A (0.63) KMT2APOLBCA1CA12CA9
SCHEMBL15101846 0.90 KMT2A (0.63) KMT2APOLBCA1CA12CA9
SCHEMBL3187312 0.81 CA12 (0.58) KMT2APOLBCA1CA12CA9
SCHEMBL9967356 0.79 KMT2A (0.85) KMT2APOLBCA1CA2ALDH1A1
SCHEMBL20589125 0.79 KMT2A (0.85) KMT2APOLBCA1CA2ALDH1A1
SCHEMBL3180414 0.78 POLB (0.69) KMT2APOLBCA1CA2L3MBTL1
SCHEMBL3180404 0.78 POLB (0.69) KMT2APOLBCA1CA2L3MBTL1
SCHEMBL9851212 0.77 KMT2A (0.63) KMT2ACA1CA2ALDH1A1
SCHEMBL20968094 0.76 KMT2A (0.61) KMT2APOLBCA1CA2ALDH1A1
SCHEMBL13501891 0.76 CMA1 (0.51) KMT2APOLBCA1CA12CA9

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-0948563-B1 MODIFYING AGENTS FOR POLYOLEFINS MINNESOTA MINING & MFG (US) 2005-02-02 EP disclosed
US-6096811-A COMPOSITION COMPRISING POLYOLEFIN, ANTIOXIDANT, NUCLEATING OR CLARIFYING AGENT 3M INNOVATIVE PROPERTIES COMPANY (US) 2000-08-01 US disclosed