SCHEMBL14535326

SCHEMBL14535326

CNc1cccc(-n2nnnc2S)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 10/20 0.42
▸ L3MBTL1 Q9Y468 4/20 0.42
▸ LMNA P02545 6/20 0.39
▸ MAPT P10636 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ TP53 P04637 3/20 0.39
▸ RAB9A P51151 5/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ NPSR1 Q6W5P4 3/20 0.38
▸ S1PR4 O95977 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ S1PR1 P21453 2/20 0.38
▸ HTT P42858 2/20 0.38
▸ CRHBP P24387 1/20 0.35
▸ CRHR2 Q13324 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ GAA P10253 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34

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
SCHEMBL14288404 0.84 ALDH1A1 (0.39) ALDH1A1L3MBTL1LMNAMAPTSMN1; SMN2
SCHEMBL14535300 0.84 ALDH1A1 (0.39) ALDH1A1L3MBTL1LMNAMAPTSMN1; SMN2
SCHEMBL1336437 0.82 ALDH1A1 (0.41) ALDH1A1L3MBTL1LMNAMAPTSMN1; SMN2
SCHEMBL29870318 0.81 IDO1 (0.54) ALDH1A1L3MBTL1LMNAMAPTRAB9A
SCHEMBL1537861 0.81 IDO1 (0.54) ALDH1A1L3MBTL1LMNAMAPTRAB9A
SCHEMBL11145169 0.81 LMNA (0.47) ALDH1A1L3MBTL1LMNAMAPTSMN1; SMN2
SCHEMBL14441128 0.81 ALDH1A1 (0.37) ALDH1A1L3MBTL1LMNAMAPTSMN1; SMN2
SCHEMBL7954313 0.80 IDO1 (0.53) ALDH1A1L3MBTL1LMNAMAPTTP53
SCHEMBL7954309 0.80 IDO1 (0.53) ALDH1A1L3MBTL1LMNAMAPTTP53
Bromide SCHEMBL7951258 0.80 IDO1 (0.53) ALDH1A1L3MBTL1LMNAMAPTTP53

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-7211373-B2 Photothermographic material FUJIFILM CORPORATION (JP) 2007-05-01 — — US disclosed
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