SCHEMBL30385992

SCHEMBL30385992

C1=Cc2nc1c(-c1cccnc1)c1ccc([nH]1)c(-c1cccnc1)c1nc(c(-c3cccnc3)c3ccc([nH]3)c2-c2cccnc2)C=C1.[Ni+2]

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 4/20 0.52
▸ TOP1 P11387 2/20 0.51
▸ CYP19A1 P11511 2/20 0.47
▸ CYCS P99999 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2A6 P11509 1/20 0.45
▸ ENPP2 Q13822 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ LDHA P00338 1/20 0.44
▸ EPHX2 P34913 1/20 0.44
▸ STAT3 P40763 1/20 0.43
▸ STAT1 P42224 1/20 0.43

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
SCHEMBL29501072 0.98 TERT (0.54) TERTTOP1CYP19A1CYCSALDH1A1
SCHEMBL185112 0.98 TERT (0.54) TERTTOP1CYP19A1CYCSALDH1A1
SCHEMBL29021355 0.97 TERT (0.52) TERTTOP1CYP19A1CYCSALDH1A1
SCHEMBL21808804 0.97 TERT (0.52) TERTTOP1CYP19A1CYCSALDH1A1
SCHEMBL2423305 0.97 TERT (0.52) TERTTOP1CYP19A1CYCSALDH1A1
SCHEMBL14445603 0.92 TOP1 (0.62) TERTTOP1CYP19A1CYCSALDH1A1
SCHEMBL7240122 0.88 TOP1 (0.70) TERTTOP1CYP19A1CYCSENPP2
SCHEMBL7240682 0.88 TERT (0.46) TERTTOP1CYP19A1CYCSENPP2
SCHEMBL7246924 0.84 TOP1 (0.53) TERTTOP1CYP19A1CYCSALDH1A1
SCHEMBL17366430 0.82 CYP19A1 (0.41) TERTTOP1CYP19A1CYCSALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115928098-B Tetrapyridyl nickel porphyrin/carbon nano tube dual-function electrocatalyst and preparation method and application thereof 肇庆学院 2025-02-28 — — CN claimed
CN-115928098-A Tetrapyridyl nickel porphyrin/carbon nanotube bifunctional electrocatalyst and preparation method and application thereof 肇庆学院 2023-04-07 — — CN claimed
CN-115928098-B Tetrapyridyl nickel porphyrin/carbon nano tube dual-function electrocatalyst and preparation method and application thereof 肇庆学院 2025-02-28 — — CN disclosed
CN-115928098-B Tetrapyridyl nickel porphyrin/carbon nano tube dual-function electrocatalyst and preparation method and application thereof 肇庆学院 2025-02-28 — — CN disclosed
CN-115928098-A Tetrapyridyl nickel porphyrin/carbon nanotube bifunctional electrocatalyst and preparation method and application thereof 肇庆学院 2023-04-07 — — CN disclosed
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