SCHEMBL23926532

SCHEMBL23926532

Nc1ccc2nc(-c3ccco3)sc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.59
▸ KDM4E B2RXH2 4/20 0.59
▸ GLA P06280 4/20 0.59
▸ GAA P10253 4/20 0.59
▸ SMN1; SMN2 Q16637 4/20 0.59
▸ ALDH1A1 P00352 3/20 0.59
▸ PKM P14618 2/20 0.59
▸ HPGD P15428 2/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ NPC1 O15118 3/20 0.58
▸ RAB9A P51151 3/20 0.58
▸ TP53 P04637 2/20 0.57
▸ POLB P06746 1/20 0.57
▸ PTBP1 P26599 1/20 0.57
▸ CASP1 P29466 1/20 0.57
▸ CASP7 P55210 1/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ APP P05067 6/20 0.52
▸ THRB P10828 1/20 0.52

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
Hydrochloric Acid SCHEMBL22130191 0.98 MAPT (0.57) MAPTKDM4EGLAGAASMN1; SMN2
SCHEMBL2222770 0.79 ILK (0.60) MAPTKDM4EGLAGAASMN1; SMN2
Cyanide SCHEMBL22130193 0.76 ILK (0.39) MAPTKDM4EGLAGAASMN1; SMN2
SCHEMBL6854931 0.76 MAPT (0.73) MAPTKDM4EGLAGAASMN1; SMN2
SCHEMBL6854930 0.75 MAPT (0.96) MAPTKDM4EGLAGAASMN1; SMN2
SCHEMBL3194266 0.74 MAPT (1.00) MAPTKDM4EGLAGAASMN1; SMN2
SCHEMBL5535916 0.74 MAPT (0.90) MAPTKDM4EGLAGAASMN1; SMN2
SCHEMBL1995933 0.74 MAPT (1.00) MAPTKDM4EGLAGAASMN1; SMN2
SCHEMBL30943961 0.74 PIK3R1 (0.39) MAPTKDM4EALDH1A1PKMHPGD
SCHEMBL11749206 0.73 MAPT (1.00) MAPTKDM4EGLAGAASMN1; 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-3901139-A1 NOVEL HYDRAZONE DERIVATIVE WITH ARYL OR HETEROARYL GROUP SUBSTITUTED AT TERMINAL AMINE GROUP THEREOF AND USE THEREOF Korea Institute of Science and Technology (KR) 2021-10-27 — — EP disclosed
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