SCHEMBL28009257

SCHEMBL28009257

Nc1ccccc1C1=CC2=CC3=NC(=CC4=NC(=C(c5ccccc5)C5=NC(=C(c6ccccc6)C1=N2)C=C5)C=C4)C=C3

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31

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
SCHEMBL28008851 0.90 — —
SCHEMBL27931186 0.88 CYP3A4 (0.31) HSD17B10
SCHEMBL28024657 0.88 — —
SCHEMBL28541499 0.87 ALDH1A1 (0.35) ALDH1A1HSD17B10
SCHEMBL28188074 0.86 — —
SCHEMBL27883625 0.86 — —
SCHEMBL27931180 0.85 CYP3A4 (0.33) HSD17B10
SCHEMBL28121970 0.85 MAOA (0.33) ALDH1A1
SCHEMBL27940872 0.84 CYP3A4 (0.32) HSD17B10
SCHEMBL1758696 0.84 ALDH1A1 (0.33) ALDH1A1HSD17B10

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 4 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
CN-104865292-A Nitrogen dioxide gas sensor based on o-aminophenyl substituted porphyrin nanometer material UNIV JINAN 2015-08-26 — — CN disclosed
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