SCHEMBL27603604

SCHEMBL27603604

COc1ccccc1-c1cc2cc3nc(cc4ccc(cc5nc(cc1[nH]2)C=C5)[nH]4)C=C3.[Pt]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.43
▸ HPGD P15428 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ PDE5A O76074 4/20 0.41
▸ AURKA O14965 1/20 0.41
▸ DCUN1D1 Q96GG9 2/20 0.40
▸ GAA P10253 1/20 0.39
▸ AMY1A P0DUB6 1/20 0.38
▸ MPO P05164 1/20 0.37
▸ ALPL P05186 1/20 0.37
▸ PARP1 P09874 1/20 0.37
▸ CCNB2 O95067 1/20 0.36
▸ CDK1 P06493 1/20 0.36
▸ CCNB1 P14635 1/20 0.36

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
SCHEMBL3276862 0.99 ALDH1A1 (0.43) ALDH1A1HPGDSMN1; SMN2KDM4EMEN1
SCHEMBL28478667 0.97 ALDH1A1 (0.43) ALDH1A1HPGDSMN1; SMN2KDM4EMEN1
SCHEMBL30530985 0.87 FGFR1 (0.40) ALDH1A1HPGDSMN1; SMN2KDM4EMEN1
SCHEMBL1945082 0.81 STAT3 (0.54) ALDH1A1HPGDSMN1; SMN2KDM4EMEN1
SCHEMBL29901368 0.81 PDE5A (0.48) ALDH1A1HPGDKDM4EMEN1MAPT
SCHEMBL5487566 0.81 NPC1 (0.42) ALDH1A1HPGDSMN1; SMN2RAB9ANPSR1
SCHEMBL1271006 0.81 AMY1A (0.39) ALDH1A1HPGDSMN1; SMN2KDM4EMEN1
SCHEMBL480532 0.80 STAT3 (0.37) ALDH1A1HPGDSMN1; SMN2KDM4EMEN1
SCHEMBL30497518 0.80 STAT3 (0.37) ALDH1A1HPGDSMN1; SMN2KDM4EMEN1
SCHEMBL845873 0.80 AMY1A (0.38) ALDH1A1HPGDSMN1; SMN2KDM4EMEN1

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
CN-1635654-A Application of products with active carbon surface chemically decorated by porphyrin and phthalocyanine in fuel cells UNIV SHANDONG TECHNOLOGY (CN) 2005-07-06 — — CN disclosed
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