SCHEMBL28252316

SCHEMBL28252316

CCCCc1c(-c2ccccc2)c2cc3nc(cc4ccc(cc5nc(cc1[nH]2)C=C5)[nH]4)C=C3

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.45
▸ STAT1 P42224 1/20 0.45
▸ DCTPP1 Q9H773 1/20 0.39
▸ GCGR P47871 2/20 0.38
▸ KDM4E B2RXH2 4/20 0.38
▸ HSD17B10 Q99714 3/20 0.38
▸ TSHR P16473 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ PSMB5 P28074 1/20 0.35
▸ GABRP O00591 1/20 0.34
▸ GABRD O14764 1/20 0.34
▸ GABRA1 P14867 1/20 0.34
▸ IDO1 P14902 1/20 0.34
▸ GABRB1 P18505 1/20 0.34
▸ GABRG2 P18507 1/20 0.34
▸ GABRB3 P28472 1/20 0.34
▸ GABRA5 P31644 1/20 0.34
▸ GABRA3 P34903 1/20 0.34
▸ GABRA2 P47869 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
SCHEMBL27971649 0.99 STAT3 (0.44) STAT3STAT1DCTPP1GCGRKDM4E
SCHEMBL28019877 0.95 STAT3 (0.43) STAT3STAT1DCTPP1GCGRKDM4E
SCHEMBL27928191 0.85 STAT3 (0.47) STAT3STAT1KDM4ETSHRL3MBTL1
SCHEMBL27790181 0.82 STAT3 (0.49) STAT3STAT1KDM4EHSD17B10TSHR
SCHEMBL4944697 0.82 KCNH2 (0.34) KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL28087191 0.81 STAT3 (0.42) STAT3STAT1KDM4EHSD17B10TSHR
SCHEMBL28169160 0.81 STAT3 (0.42) STAT3STAT1KDM4EHSD17B10TSHR
SCHEMBL226837 0.81 STAT3 (0.59) STAT3STAT1KDM4EHSD17B10TSHR
SCHEMBL31499126 0.80 STAT3 (0.52) STAT3STAT1KDM4EHSD17B10TP53
SCHEMBL14054511 0.80 STAT3 (0.57) STAT3STAT1KDM4EHSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106854215-B A kind of novel Ratio-type lead (II) ion fluorescence probe and the preparation method and application thereof 济南大学 2018-11-06 — — CN disclosed
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