SCHEMBL10482856

SCHEMBL10482856

Fc1ccccc1-c1c2nc(cc3ccc(cc4nc(cc5ccc1[nH]5)C=C4)[nH]3)C=C2

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.58
▸ STAT1 P42224 1/20 0.58
▸ NPC1 O15118 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ TRPA1 O75762 1/20 0.35
▸ MGAM O43451 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ SI P14410 1/20 0.35
▸ MGAM2 Q2M2H8 1/20 0.35
▸ DHODH Q02127 3/20 0.34
▸ DCUN1D1 Q96GG9 1/20 0.33

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
SCHEMBL7269032 0.84 STAT3 (0.58) STAT3STAT1
SCHEMBL27579991 0.84 STAT3 (0.58) STAT3STAT1NPC1ALDH1A1RAB9A
SCHEMBL9764318 0.84 STAT3 (0.58) STAT3STAT1NPC1ALDH1A1RAB9A
SCHEMBL2849607 0.84 STAT3 (0.58) STAT3STAT1NPC1ALDH1A1RAB9A
SCHEMBL6892151 0.84 STAT3 (0.58) STAT3STAT1NPC1ALDH1A1RAB9A
SCHEMBL20520075 0.83 STAT3 (0.59) STAT3STAT1TRPA1DHODH
SCHEMBL11328879 0.83 STAT3 (0.56) STAT3STAT1GAA
SCHEMBL4269117 0.82 STAT3 (0.55) STAT3STAT1TRPA1DHODH
SCHEMBL311440 0.82 STAT3 (0.55) STAT3STAT1
SCHEMBL8689812 0.81 STAT3 (0.60) STAT3STAT1NPC1ALDH1A1RAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1056435-A — — None — — JP disclosed
JP-S6456435-A WAVELENGTH MULTIPLE RECORDING MATERIAL AGENCY IND SCIENCE TECHN 1989-03-03 — — JP disclosed
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