SCHEMBL28335780

SCHEMBL28335780

C1=Cc2cc3ccc(cc4nc(cc5ccc(cc1n2)[nH]5)C=C4)[nH]3.CCCCCCCCCCCC([Zn])CCCCCCCC

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 5/20 0.35
▸ KCNH2 Q12809 1/20 0.30
▸ SLC2A1 P11166 1/20 0.30
▸ LTB4R Q15722 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
SCHEMBL28333411 0.80 GPR84 (0.32) GPR84
SCHEMBL3720956 0.79 GPR84 (0.39) GPR84
SCHEMBL27845740 0.78 STAT3 (0.31) GPR84KCNH2
SCHEMBL28201336 0.78 TSHR (0.39) GPR84KCNH2
SCHEMBL28141199 0.78 STAT3 (0.31) GPR84KCNH2
Butyl Alcohol SCHEMBL27909152 0.76 ALDH1A1 (0.38) GPR84
SCHEMBL15510966 0.74 KCNH2 (0.35) GPR84KCNH2
Alcohol SCHEMBL1345780 0.73 STAT3 (0.36) —
SCHEMBL6744970 0.73 STAT3 (0.42) —
SCHEMBL9405107 0.72 STAT3 (0.35) —

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-110544743-B Efficient porphyrin material-based ternary organic solar cell and preparation method thereof 华南理工大学 2021-03-30 — — CN disclosed
CN-110544743-A Efficient porphyrin material-based ternary organic solar cell and preparation method thereof UNIV SOUTH CHINA TECH 2019-12-06 — — CN disclosed
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