SCHEMBL14724597

SCHEMBL14724597

C=C(c1ccc(-c2ccc(OCC(C)C)cc2)cc1)N(C)C(C(=O)NC)C(=O)NN=O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 2/20 0.41
▸ POLB P06746 1/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ TARBP2 Q15633 1/20 0.38

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
SCHEMBL14715097 0.78 — —
SCHEMBL14724550 0.73 PLK1 (0.44) SMN1; SMN2
SCHEMBL14724638 0.70 — —
SCHEMBL14789170 0.67 — —
SCHEMBL14714411 0.65 — —
SCHEMBL14715330 0.65 — —
SCHEMBL14789169 0.65 ALDH1A1 (0.42) —
SCHEMBL14714799 0.64 — —
SCHEMBL20851318 0.64 MAPT (0.58) NR1H4POLBNPC1TP53GAA
SCHEMBL20977148 0.64 ACACB (0.44) —

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
EP-2562155-A1 NOVEL HYDROXAMIC ACID DERIVATIVE Taisho Pharmaceutical Co., Ltd. (JP) 2013-02-27 — — EP disclosed
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