SCHEMBL28149727

SCHEMBL28149727

Nc1cccc(-c2c3nc(c(-c4cccc(N)c4)c4ccc([nH]4)c(-c4ccccc4)c4nc(c(-c5ccccc5)c5ccc2[nH]5)C=C4)C=C3)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 2/20 0.55
▸ STAT3 P40763 1/20 0.54
▸ STAT1 P42224 1/20 0.54
▸ CYCS P99999 3/20 0.49
▸ TERT O14746 3/20 0.48
▸ KDM4E B2RXH2 3/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ HPGD P15428 3/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ TP53 P04637 1/20 0.47
▸ MAOA P21397 1/20 0.46
▸ PRMT1 Q99873 1/20 0.46
▸ MEN1 O00255 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ GFER P55789 1/20 0.44
▸ ENPP2 Q13822 1/20 0.44

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
SCHEMBL28838442 1.00 TOP1 (0.55) TOP1STAT3STAT1CYCSTERT
SCHEMBL27958997 1.00 TOP1 (0.55) TOP1STAT3STAT1CYCSTERT
SCHEMBL3178604 1.00 TOP1 (0.55) TOP1STAT3STAT1CYCSTERT
SCHEMBL30493184 0.95 TOP1 (0.55) TOP1STAT3STAT1CYCSTERT
SCHEMBL5918884 0.95 TOP1 (0.55) TOP1STAT3STAT1CYCSTERT
SCHEMBL8183442 0.90 TOP1 (0.70) TOP1STAT3STAT1CYCSTERT
SCHEMBL9388101 0.89 TOP1 (0.53) TOP1STAT3STAT1CYCSTERT
SCHEMBL2141047 0.89 STAT3 (0.63) TOP1STAT3STAT1CYCSTERT
SCHEMBL29962487 0.86 TOP1 (0.72) TOP1STAT3STAT1CYCSTERT
SCHEMBL30616040 0.86 TOP1 (0.72) TOP1STAT3STAT1CYCSTERT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107033153-B Ornithine modifies amino tetraphenylporphyrin compound and purposes 中国医学科学院生物医学工程研究所 2019-05-21 — — CN disclosed
CN-107033153-A Ornithine modifies amino tetraphenylporphyrin compound and purposes 中国医学科学院生物医学工程研究所 2017-08-11 — — CN disclosed
CN-103772399-B Preparation method and use of basic amino acid modified amidotetraphenylporphyrin compound 中国医学科学院生物医学工程研究所 2017-01-25 — — CN disclosed
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