SCHEMBL19492015

SCHEMBL19492015

Cc1ccc(O)c(NC(=O)c2ccc(Sc3ccc(C(=O)Nc4cc(C)ccc4O)cc3)cc2)c1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KCNMA1 Q12791 5/20 0.71
▸ HDAC1 Q13547 1/20 0.55
▸ P2RY14 Q15391 1/20 0.53
▸ GAA P10253 7/20 0.52
▸ NPC1 O15118 5/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ TDP1 Q9NUW8 2/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ TP53 P04637 1/20 0.52
▸ HTT P42858 2/20 0.51
▸ RAB9A P51151 3/20 0.51
▸ MAPT P10636 3/20 0.49
▸ ADRB2 P07550 1/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48

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
SCHEMBL19853328 0.91 KCNMA1 (0.62) KCNMA1HDAC1P2RY14GAANPC1
SCHEMBL6029542 0.91 KCNMA1 (0.84) KCNMA1HDAC1GAANPC1SMN1; SMN2
SCHEMBL2605548 0.89 KCNMA1 (0.82) KCNMA1HDAC1GAANPC1SMN1; SMN2
SCHEMBL14363236 0.86 KCNMA1 (0.77) KCNMA1HDAC1GAANPC1SMN1; SMN2
SCHEMBL14363234 0.83 KCNMA1 (0.72) KCNMA1HDAC1GAANPC1SMN1; SMN2
SCHEMBL10873010 0.83 KCNMA1 (1.00) KCNMA1HDAC1GAANPC1SMN1; SMN2
SCHEMBL7300963 0.82 KCNMA1 (0.71) KCNMA1HDAC1GAANPC1SMN1; SMN2
SCHEMBL12488034 0.82 KCNMA1 (0.71) KCNMA1HDAC1GAANPC1SMN1; SMN2
SCHEMBL2605541 0.82 KCNMA1 (0.71) KCNMA1HDAC1P2RY14GAANPC1
SCHEMBL2605538 0.82 KCNMA1 (0.71) KCNMA1HDAC1GAANPC1SMN1; SMN2

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-2555053-B1 POSITIVE-TYPE PHOTOSENSITIVE RESIN COMPOSITION TORAY INDUSTRIES (JP) 2017-10-18 — — EP disclosed
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