SCHEMBL13753894

SCHEMBL13753894

CCNC(=O)c1cc(C)c[nH]1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.44
▸ ALOX15 P16050 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ CREBBP Q92793 1/20 0.41
▸ PKM P14618 2/20 0.40
▸ TAS2R8 Q9NYW2 1/20 0.38
▸ LMNA P02545 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ DAO P14920 4/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ HMBS P08397 1/20 0.37
▸ BAZ2B Q9UIF8 1/20 0.37
▸ BAZ2A Q9UIF9 1/20 0.37

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
SCHEMBL163704 0.81 BRD4 (0.44) BRD4ALOX15ALDH1A1KDM4EGAA
SCHEMBL23952159 0.81 GAA (0.54) BRD4ALDH1A1KDM4EGAACREBBP
SCHEMBL18415314 0.79 CREBBP (0.63) BRD4ALOX15ALDH1A1KDM4EGAA
SCHEMBL21180765 0.77 ALDH1A1 (0.42) BRD4ALOX15ALDH1A1KDM4EGAA
SCHEMBL20094767 0.76 DAO (0.49) BRD4ALOX15ALDH1A1KDM4EGAA
SCHEMBL25782683 0.73 ALOX15 (0.44) ALOX15KDM4EGAALMNAMAPT
SCHEMBL19672566 0.72 TDP1 (0.49) BRD4KDM4EGAAMAPT
SCHEMBL2148753 0.72 GABRP (0.51) ALOX15ALDH1A1KDM4EGAALMNA
SCHEMBL13692394 0.71 — —
SCHEMBL1337277 0.71 — —

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