SCHEMBL28670273

SCHEMBL28670273

Oc1c(Br)cc(-c2cc3cc4nc(cc5ccc(cc6nc(cc2[nH]3)C=C6)[nH]5)C=C4)cc1Br

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.35
▸ STAT1 P42224 1/20 0.35
▸ AMY1A P0DUB6 4/20 0.33
▸ CRHBP P24387 1/20 0.33
▸ CRHR2 Q13324 1/20 0.33

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
SCHEMBL28999747 0.84 STAT3 (0.38) STAT3STAT1
SCHEMBL28590232 0.84 STAT3 (0.38) STAT3STAT1
SCHEMBL27888734 0.84 GABRA1 (0.45) STAT3STAT1AMY1A
SCHEMBL28586570 0.83 STAT3 (0.37) STAT3STAT1
SCHEMBL5015310 0.81 STAT3 (0.38) STAT3STAT1
SCHEMBL29960178 0.81 STAT3 (0.38) STAT3STAT1
SCHEMBL3352970 0.81 STAT3 (0.38) STAT3STAT1
SCHEMBL14973447 0.80 STAT3 (0.37) STAT3STAT1
SCHEMBL31040338 0.80 STAT3 (0.37) STAT3STAT1
SCHEMBL28367025 0.80 STAT3 (0.37) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113720833-A Lead detection method and device 杭州春来科技有限公司 2021-11-30 — — CN claimed
CN-113720833-A Lead detection method and device 杭州春来科技有限公司 2021-11-30 — — CN disclosed
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