SCHEMBL18155290

SCHEMBL18155290

Cc1cc(NC(=O)Nc2ccc(O)c(O)c2)ccc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.55
▸ RAB9A P51151 4/20 0.49
▸ MAPT P10636 3/20 0.49
▸ NPC1 O15118 3/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ HSP90AA1 P07900 1/20 0.49
▸ HSP90AB1 P08238 1/20 0.49
▸ GBA1 P04062 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ POLB P06746 2/20 0.47
▸ SNCA P37840 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.46
▸ TOP1 P11387 1/20 0.46
▸ PIM1 P11309 1/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45

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
SCHEMBL109020 0.88 ALOX15 (0.66) ALOX15RAB9AMAPTSNCATOP1
SCHEMBL10242035 0.86 MAOA (0.59) ALOX15RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL11563350 0.85 POLB (0.53) RAB9AMAPTNPC1HSP90AA1HSP90AB1
SCHEMBL4686246 0.82 HSP90AA1 (0.53) RAB9AMAPTNPC1HSP90AA1HSP90AB1
SCHEMBL7547627 0.81 ALDH1A1 (0.59) RAB9AMAPTNPC1SMN1; SMN2HSP90AA1
SCHEMBL19427497 0.81 ALOX15 (0.63) ALOX15RAB9AMAPTSNCAALDH1A1
SCHEMBL13804531 0.81 ALDH1A1 (0.55) ALOX15MAPTSMN1; SMN2POLBSNCA
SCHEMBL12937374 0.81 TOP1 (0.74) ALOX15RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL13772128 0.79 ALOX15 (0.71) ALOX15RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL22125519 0.78 SMARCA2 (0.69) RAB9ANPC1SMN1; SMN2MEN1KMT2A

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-9469605-B2 Compounds and compositions for use a modulators of tau aggregation and alleviation of tauopathies PROTAMED, INC. (US) 2016-10-18 — — US disclosed
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