SCHEMBL27919288

SCHEMBL27919288

O=C(O)c1ccc(Oc2cccc3c4nc5nc(nc6[nH]c(nc7nc(nc([nH]4)c23)-c2ccccc2-7)c2ccccc62)-c2ccccc2-5)cc1.[Zn]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CAMKK2 Q96RR4 1/20 0.41
▸ FEN1 P39748 2/20 0.39
▸ PTPN1 P18031 1/20 0.39
▸ PIN1 Q13526 1/20 0.39
▸ SRD5A2 P31213 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ MITF O75030 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ BRD4 O60885 3/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HDAC1 Q13547 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
SCHEMBL28567301 0.99 CAMKK2 (0.42) CAMKK2FEN1PTPN1PIN1SRD5A2
SCHEMBL27901590 0.89 AKR1C3 (0.45) CAMKK2PTPN1BRD4
SCHEMBL7131959 0.88 BRD4 (0.36) CAMKK2MEN1LMNAKMT2AKDM4E
SCHEMBL28662842 0.86 FFAR1 (0.45) SRD5A2BRD4HDAC1HDAC6
SCHEMBL27901591 0.85 HTT (0.40) MEN1MITFLMNAPOLBKMT2A
SCHEMBL1325770 0.85 PIN1 (0.41) CAMKK2PIN1SRD5A2CYP1A2CYP3A4
SCHEMBL28097985 0.84 PIN1 (0.35) CAMKK2PTPN1PIN1SRD5A2MEN1
SCHEMBL7520606 0.84 HTT (0.41) MEN1MITFLMNAPOLBKMT2A
SCHEMBL5972535 0.83 MEN1 (0.36) MEN1LMNAKMT2AL3MBTL1KDM4E
SCHEMBL28659712 0.83 SRD5A2 (0.43) CAMKK2PIN1SRD5A2MEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102552907-B Application of non-surrounding displaced phthalocyanine zinc in preparing sonosensitizer UNIV FUZHOU 2013-05-08 — — CN claimed
CN-113943304-B Pim-1 kinase targeted phthalocyanine-5-bromo-1-benzofuran-2-carboxylic acid complex, and preparation method and application thereof 福州大学 2024-01-30 — — CN disclosed
CN-114409663-B Zinc phthalocyanine 3-chloro-6 methylbenzo [ b ] thiophene-2-carboxylic acid conjugates targeting Mcl-1 enzyme and methods of making the same 福州大学 2023-05-30 — — CN disclosed
CN-115947742-A Imidazotetrazine group monosubstituted phthalocyanine conjugate and preparation method and application thereof 福州大学 2023-04-11 — — CN disclosed
CN-115160326-A Phthalocyanine complex of targeted IDO enzyme and preparation method and application thereof 福州大学 2022-10-11 — — CN disclosed
CN-114409663-A Mcl-1 enzyme targeted zinc phthalocyanine 3-chloro-6 methylbenzo [ b ] thiophene-2-carboxylic acid conjugates and methods of making the same 福州大学 2022-04-29 — — CN disclosed
CN-113943304-A Phthalocyanine-5-bromo-1-benzofuran-2-carboxylic acid complex targeting Pim-1 kinase and preparation method and application thereof 福州大学 2022-01-18 — — CN disclosed
CN-112209940-A COX-2 enzyme-targeted phthalocyanine-indometacin complex and preparation method and application thereof 福州大学 2021-01-12 — — CN disclosed
CN-102552907-B Application of non-surrounding displaced phthalocyanine zinc in preparing sonosensitizer UNIV FUZHOU 2013-05-08 — — CN disclosed
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