SCHEMBL28410890

SCHEMBL28410890

C1=Cc2cc3ccc(cc4nc(cc5ccc(cc1n2)[nH]5)C=C4)[nH]3.CCCCCCC(CCCC)COc1ccc([Zn])cc1F

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ S1PR4 O95977 1/20 0.31
▸ S1PR1 P21453 1/20 0.31
▸ S1PR3 Q99500 1/20 0.31
▸ S1PR5 Q9H228 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
SCHEMBL28403635 0.85 PLA2G2A (0.34) S1PR1
SCHEMBL28411429 0.84 S1PR4 (0.34) S1PR4S1PR1S1PR3S1PR5
SCHEMBL28408311 0.72 PLA2G2A (0.36) —
SCHEMBL28335780 0.72 GPR84 (0.35) —
SCHEMBL28410138 0.69 ALDH1A1 (0.43) S1PR1S1PR3
SCHEMBL28700278 0.68 GPR84 (0.33) —
SCHEMBL28698770 0.68 GPR84 (0.31) —
SCHEMBL28286891 0.67 GPR84 (0.30) —
SCHEMBL28201336 0.67 TSHR (0.39) —
SCHEMBL28333411 0.65 GPR84 (0.32) —

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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