SCHEMBL27406238

SCHEMBL27406238

Cc1cc2cc3nc(cc4ccc(cc5nc(cc1[nH]2)-c1ccccc1-5)[nH]4)C=C3

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.37
▸ STAT1 P42224 1/20 0.37
▸ NPC1 O15118 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ MGAM O43451 3/20 0.30
▸ GAA P10253 3/20 0.30
▸ SI P14410 3/20 0.30
▸ MGAM2 Q2M2H8 3/20 0.30
▸ METAP2 P50579 1/20 0.30
▸ METAP1 P53582 1/20 0.30
▸ CBFB Q13951 1/20 0.30

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
SCHEMBL29459652 0.85 STAT3 (0.40) STAT3STAT1
SCHEMBL2979039 0.85 STAT3 (0.40) STAT3STAT1
SCHEMBL3522157 0.85 STAT3 (0.40) STAT3STAT1
SCHEMBL27308 0.85 STAT3 (0.40) STAT3STAT1
SCHEMBL16286470 0.84 STAT3 (0.39) STAT3STAT1
SCHEMBL9679890 0.84 STAT3 (0.39) STAT3STAT1
SCHEMBL30713723 0.84 STAT3 (0.39) STAT3STAT1
SCHEMBL457013 0.84 STAT3 (0.39) STAT3STAT1
SCHEMBL5144296 0.84 STAT3 (0.39) STAT3STAT1
SCHEMBL30713725 0.84 STAT3 (0.39) STAT3STAT1

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
CN-1095333-C Fungicidal compositions for enhancement of turf quality UNIV NORTH CAROLINA STATE (US) 2002-12-04 — — CN disclosed
CN-1180298-A Fungicidal compositions for enhancement of turf quality UNIV NORTH CAROLINA STATE (US) 1998-04-29 — — CN disclosed
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