SCHEMBL11119366

SCHEMBL11119366

C/N=N/c1cccc(N)c1/N=N/C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CYP3A4 P08684 5/20 0.37
▸ TSHR P16473 3/20 0.37
▸ PIK3CA P42336 1/20 0.37
▸ TDP1 Q9NUW8 3/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ HPGD P15428 2/20 0.33
▸ CD44 P16070 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32

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
SCHEMBL14366502 0.79 L3MBTL1 (0.71) GAANPC1RAB9AL3MBTL1CYP3A4
SCHEMBL19088907 0.78 CD44 (0.48) GAANPC1RAB9AL3MBTL1CYP3A4
SCHEMBL10818679 0.73 — —
SCHEMBL4465102 0.70 NPC1 (0.41) GAANPC1RAB9AL3MBTL1CYP3A4
SCHEMBL17323134 0.67 CYP1A2 (0.33) NPC1RAB9AL3MBTL1TDP1SMN1; SMN2
SCHEMBL3338118 0.65 TDP1 (0.54) GAANPC1RAB9AL3MBTL1CYP3A4
SCHEMBL28418204 0.65 CYP3A4 (0.62) GAANPC1RAB9AL3MBTL1CYP3A4
SCHEMBL4567367 0.65 TDP1 (0.66) GAANPC1RAB9AL3MBTL1CYP3A4
Hydrochloric Acid SCHEMBL9012868 0.64 TDP1 (0.53) GAANPC1RAB9AL3MBTL1CYP3A4
SCHEMBL6227112 0.64 NPC1 (0.62) GAANPC1RAB9AL3MBTL1CYP3A4

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-0109624-A2 Process for producing shaped articles made from polyurethane-polyurea which may be cellular BASF Aktiengesellschaft (DE) 1984-05-30 — — EP disclosed
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