SCHEMBL11656337

SCHEMBL11656337

COC(=O)Nc1cccc2c1C(=O)c1ccccc1-2

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.64
PTPRC P08575 1/20 0.63
PTPN13 Q12923 1/20 0.63
MAPT P10636 5/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
EGFR P00533 1/20 0.53
PABPC1 P11940 1/20 0.53
MAPK1 P28482 1/20 0.53
RAB9A P51151 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
FUCA1 P04066 1/20 0.52
ALDH1A1 P00352 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
LMNA P02545 2/20 0.50
TERT O14746 2/20 0.50
KDM4E B2RXH2 1/20 0.50
POLB P06746 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL11742788 0.93 MAOA (0.73) MAOAPTPRCPTPN13MAPTSMN1; SMN2
SCHEMBL13564137 0.87 MAOA (0.51) MAOAPTPRCPTPN13MAPTSMN1; SMN2
SCHEMBL7818784 0.85 MAOA (0.87) MAOAPTPRCPTPN13MAPTSMN1; SMN2
SCHEMBL20892849 0.82 MAOA (0.62) MAOAPTPRCPTPN13MAPTSMN1; SMN2
SCHEMBL11660328 0.80 HPGD (0.50) MAOAPTPRCPTPN13MAPTSMN1; SMN2
SCHEMBL11657197 0.80 HPGD (0.53) MAOAMAPTSMN1; SMN2RAB9AL3MBTL1
SCHEMBL15245123 0.79 MAOA (0.58) MAOAPTPRCPTPN13MAPTSMN1; SMN2
SCHEMBL6263283 0.78 PTPRC (1.00) MAOAPTPRCPTPN13MAPTALDH1A1
SCHEMBL2601918 0.78 MAOA (1.00) MAOAMAPTSMN1; SMN2EGFRPABPC1
SCHEMBL11659356 0.78 HPGD (0.64) SMN1; SMN2RAB9AL3MBTL1ALDH1A1MEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4069240-A GROUP 8 METAL CATALYST UNIROYAL, INC. (US) 1978-01-17 US disclosed