SCHEMBL570956

SCHEMBL570956

CCNC(=O)c1cc2cc(C=CC(=O)c3ccc(C)cc3)ccc2oc1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.49
F12 P00748 7/20 0.49
MAOA P21397 1/20 0.47
ACHE P22303 1/20 0.47
MAPT P10636 2/20 0.46
MGAM O43451 1/20 0.46
GAA P10253 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
KMT2A Q03164 1/20 0.44
TP53 P04637 1/20 0.44
THRB P10828 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44

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
SCHEMBL570975 0.80 MAOB (0.39) MAOBMAOAMAPTCA1CA2
SCHEMBL570973 0.80 MAOB (0.39) MAOBMAOAMAPTCA1CA2
SCHEMBL570890 0.71 MAOB (0.39) MAOBMAOAMAPTGAACA1
SCHEMBL570888 0.71 MAOB (0.39) MAOBMAOAMAPTGAACA1
SCHEMBL15058644 0.71 MAOB (0.73) MAOBMAOAKMT2AKDM4ESMN1; SMN2
SCHEMBL28459677 0.71 MAOB (0.62) MAOBMAOAMAPTMGAMGAA
SCHEMBL28459676 0.71 MAOB (0.62) MAOBMAOAMAPTMGAMGAA
SCHEMBL570957 0.69 MAPT (0.46) MAOBMAOAACHEMAPTKMT2A
SCHEMBL10080475 0.68 MAOA (0.60) MAOBMAOAGAACA12CA1
SCHEMBL571130 0.67 GPR35 (0.41) MAOBMAOAMAPTCA12CA1

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-2601183-A1 COUMARIN-CHALCONES AS ANTICANCER AGENTS Council Of Scientific & Industrial Research (IN) 2013-06-12 EP disclosed
WO-2012017454-A1 COUMARIN-CHALCONES AS ANTICANCER AGENTS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2012-02-09 WO disclosed