SCHEMBL28890811

SCHEMBL28890811

COc1ccc(-c2cc3cc4nc(c(-c5ccccc5)c5ccc(cc6nc(c(-c7ccccc7)c2[nH]3)C=C6)[nH]5)C=C4)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.60
▸ STAT1 P42224 1/20 0.60
▸ KDM4E B2RXH2 8/20 0.38
▸ MAPT P10636 8/20 0.38
▸ KMT2A Q03164 5/20 0.38
▸ NPC1 O15118 4/20 0.38
▸ RAB9A P51151 4/20 0.38
▸ MEN1 O00255 4/20 0.38
▸ ALDH1A1 P00352 5/20 0.37
▸ TP53 P04637 3/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ HPGD P15428 3/20 0.37
▸ ACACA Q13085 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ NFKB2 Q00653 1/20 0.37
▸ RELA Q04206 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ CASP3 P42574 1/20 0.36
▸ SENP8 Q96LD8 1/20 0.36

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
SCHEMBL30948629 0.95 STAT3 (0.52) STAT3STAT1KDM4EMAPTKMT2A
SCHEMBL28188073 0.91 STAT3 (0.72) STAT3STAT1
SCHEMBL28008850 0.87 STAT3 (0.67) STAT3STAT1
SCHEMBL27940870 0.87 STAT3 (0.63) STAT3STAT1KDM4EMAPTKMT2A
SCHEMBL28406752 0.87 STAT3 (0.63) STAT3STAT1MAPTTP53MAPK13
SCHEMBL29253192 0.87 STAT3 (0.63) STAT3STAT1MAPTTP53MAPK13
SCHEMBL4266558 0.86 STAT3 (0.63) STAT3STAT1KDM4EMAPTNPC1
SCHEMBL28939046 0.86 STAT3 (0.62) STAT3STAT1KDM4EMAPTKMT2A
SCHEMBL27571718 0.85 STAT3 (0.65) STAT3STAT1MAPK13RAF1MAPK12
SCHEMBL29904993 0.85 STAT3 (0.62) STAT3STAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111233876-B Fluorescent probe for detecting hydrogen sulfide and preparation method and application thereof 湖南科技大学 2021-11-09 — — CN claimed
CN-111233876-A Fluorescent probe for rapidly detecting hydrogen sulfide and preparation method and application thereof 湖南科技大学 2020-06-05 — — CN claimed
CN-111233876-B Fluorescent probe for detecting hydrogen sulfide and preparation method and application thereof 湖南科技大学 2021-11-09 — — CN disclosed
CN-111233876-A Fluorescent probe for rapidly detecting hydrogen sulfide and preparation method and application thereof 湖南科技大学 2020-06-05 — — CN disclosed
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