SCHEMBL28403635

SCHEMBL28403635

C1=Cc2cc3ccc(cc4nc(cc5ccc(cc1n2)[nH]5)C=C4)[nH]3.CCCCCCC(CCCC)COc1ccc([Zn])cc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 8/20 0.34
▸ PLA2G10 O15496 1/20 0.33
▸ PLA2G1B P04054 1/20 0.33
▸ PLA2G5 P39877 1/20 0.33
▸ SLC2A1 P11166 1/20 0.33
▸ PLA2G4B P0C869 1/20 0.31
▸ RAB9A P51151 2/20 0.30
▸ SMN1; SMN2 Q16637 2/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ S1PR1 P21453 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ HPGD P15428 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
SCHEMBL28410890 0.85 S1PR4 (0.31) S1PR1
SCHEMBL28408311 0.85 PLA2G2A (0.36) PLA2G2APLA2G10PLA2G1BPLA2G5SLC2A1
SCHEMBL28335780 0.76 GPR84 (0.35) SLC2A1
SCHEMBL28700278 0.72 GPR84 (0.33) —
SCHEMBL27971513 0.71 KDM4E (0.36) SLC2A1RAB9ASMN1; SMN2NPC1LMNA
SCHEMBL28698770 0.71 GPR84 (0.31) —
SCHEMBL1931947 0.71 RARB (0.46) PLA2G2ASLC2A1PLA2G4BS1PR1
SCHEMBL28246174 0.70 HPGD (0.42) PLA2G2ARAB9ASMN1; SMN2LMNAPOLB
SCHEMBL28286891 0.70 GPR84 (0.30) —
SCHEMBL28839759 0.70 TSHR (0.55) PLA2G4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111187271-B Porphyrin organic small molecule receptor material, preparation method thereof and application thereof in organic solar cell 华南理工大学 2021-05-14 — — CN disclosed
CN-111187271-A Porphyrin organic small molecule receptor material, preparation method thereof and application thereof in organic solar cell 华南理工大学 2020-05-22 — — CN disclosed
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