SCHEMBL28019877

SCHEMBL28019877

CCCCCCCCCCCCc1c(-c2ccccc2)c2cc3nc(cc4ccc(cc5nc(cc1[nH]2)C=C5)[nH]4)C=C3

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.43
▸ STAT1 P42224 1/20 0.43
▸ GCGR P47871 2/20 0.42
▸ DHFR P00374 1/20 0.40
▸ DCTPP1 Q9H773 1/20 0.35
▸ GPR84 Q9NQS5 1/20 0.35
▸ CNR1 P21554 1/20 0.35
▸ CNR2 P34972 1/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ XBP1 P17861 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ HSD11B1 P28845 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ HPGD P15428 1/20 0.34

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
SCHEMBL28252316 0.95 STAT3 (0.45) STAT3STAT1GCGRDHFRDCTPP1
SCHEMBL27971649 0.94 STAT3 (0.44) STAT3STAT1GCGRDHFRDCTPP1
SCHEMBL4944697 0.85 KCNH2 (0.34) GPR84HSD17B10LMNAMAPTXBP1
SCHEMBL28169160 0.84 STAT3 (0.42) STAT3STAT1DHFRCNR2HSD17B10
SCHEMBL28087191 0.84 STAT3 (0.42) STAT3STAT1DHFRCNR2HSD17B10
SCHEMBL27928191 0.83 STAT3 (0.47) STAT3STAT1HTTKDM4EALDH1A1
SCHEMBL3720964 0.83 KCNH2 (0.34) GPR84HSD17B10LMNAMAPTXBP1
SCHEMBL27790181 0.80 STAT3 (0.49) STAT3STAT1HSD17B10LMNAMAPT
SCHEMBL226837 0.79 STAT3 (0.59) STAT3STAT1HSD17B10LMNAMAPT
SCHEMBL31499126 0.79 STAT3 (0.52) STAT3STAT1HSD17B10MAPTHTT

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-104718273-B Composition, equipment, system and method for clearing up excited electronic state 浩思特创新科技公司 2017-08-25 — — CN disclosed
CN-104718273-A Compositions, apparatus, systems, and methods for resolving electronic excited states HALLSTAR INNOVATIONS CORP 2015-06-17 — — CN disclosed
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