SCHEMBL28401041

SCHEMBL28401041

O=C(O)c1ccc(C2=C([Mn])C3=NC2=CC2=NC(=CC4=NC(=CC5=NC(=C3)C=C5)C=C4)C=C2)cc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 1/20 0.31
▸ BAD Q92934 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ TPMT P51580 1/20 0.30
▸ TOP1 P11387 1/20 0.30
▸ MKNK1 Q9BUB5 1/20 0.30
▸ MKNK2 Q9HBH9 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ RAB9A P51151 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
SCHEMBL29286965 0.81 — —
SCHEMBL28613259 0.81 ENPP2 (0.31) —
SCHEMBL28930126 0.76 BCL2L1 (0.33) BCL2L1BADTP53TSHRTPMT
SCHEMBL28332937 0.75 BCL2L1 (0.33) BCL2L1BADTP53TSHRTOP1
SCHEMBL28807790 0.75 BCL2L1 (0.33) BCL2L1BADTP53TSHRTOP1
SCHEMBL28351381 0.75 BCL2L1 (0.33) BCL2L1BADTP53TSHRTOP1
SCHEMBL11337785 0.75 BCL2L1 (0.33) BCL2L1BADTP53TSHRTOP1
SCHEMBL28089246 0.75 BCL2L1 (0.33) BCL2L1BADTP53TSHRTPMT
SCHEMBL29163495 0.72 NPC1 (0.37) MKNK1MKNK2NPC1RAB9A
SCHEMBL28049799 0.72 SENP1 (0.30) —

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-111146452-B Porphyrin zeolite imidazole framework hybrid electrocatalyst and preparation method and application thereof 大连理工大学 2021-10-22 — — CN claimed
CN-111146452-A Porphyrin zeolite imidazole framework hybrid electrocatalyst and preparation method and application thereof 大连理工大学 2020-05-12 — — CN claimed
CN-111146452-B Porphyrin zeolite imidazole framework hybrid electrocatalyst and preparation method and application thereof 大连理工大学 2021-10-22 — — CN disclosed
CN-110189620-B Fish freshness visualization intelligent tag based on metalloporphyrin MOFs, and preparation method and application thereof 上海海洋大学 2021-01-29 — — CN disclosed
CN-111146452-A Porphyrin zeolite imidazole framework hybrid electrocatalyst and preparation method and application thereof 大连理工大学 2020-05-12 — — CN disclosed
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