SCHEMBL13761357

SCHEMBL13761357

CCNC(=O)c1ccc(N=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.47
▸ CA9 Q16790 1/20 0.47
▸ KMT2A Q03164 3/20 0.45
▸ LMNA P02545 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ SCN1A P35498 1/20 0.43
▸ SCN2A Q99250 1/20 0.43
▸ SCN3A Q9NY46 1/20 0.43
▸ HDAC6 Q9UBN7 2/20 0.42
▸ HDAC4 P56524 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ PLK1 P53350 1/20 0.42
▸ OPRD1 P41143 4/20 0.41
▸ OPRM1 P35372 3/20 0.41
▸ ACACB O00763 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL5909057 0.85 CA12 (0.58) CA12CA9KMT2ALMNAMEN1
SCHEMBL19941397 0.85 KDM4E (0.57) KMT2ALMNASCN1ASCN2ASCN3A
SCHEMBL13761328 0.79 SMN1; SMN2 (0.50) KMT2AMEN1ALDH1A1ACACBNPC1
SCHEMBL14103063 0.79 SCN1A (0.68) CA12CA9KMT2ALMNAMEN1
SCHEMBL29351154 0.79 SCN1A (0.71) CA12CA9KMT2ALMNASCN1A
SCHEMBL8158111 0.78 NR1H4 (0.54) CA12CA9KMT2ALMNAMEN1
SCHEMBL12347956 0.78 EPHX2 (0.54) CA12CA9KMT2ALMNAMEN1
SCHEMBL17407652 0.78 CA12 (0.51) CA12CA9KMT2ALMNAMEN1
SCHEMBL13607305 0.78 HDAC8 (0.59) KMT2AHPGDHDAC6ALDH1A1PLK1
SCHEMBL13702393 0.78 PLK1 (0.66) CA12CA9KMT2ALMNAMEN1

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-7576117-B1 Cyclic amine CCR3 antagonist TEIJIN LIMITED (JP) 2009-08-18 — — US disclosed
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