SCHEMBL22338148

SCHEMBL22338148

Cc1cc2c(cc1Br)C(=O)c1cc(Cl)ccc1-2

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ S100A4 P26447 3/20 0.57
▸ HSP90AA1 P07900 1/20 0.45
▸ CES1 P23141 3/20 0.41
▸ BCHE P06276 1/20 0.41
▸ PPOX P50336 1/20 0.39
▸ ITGA1 P56199 1/20 0.38
▸ USP8 P40818 1/20 0.36
▸ USP7 Q93009 1/20 0.36
▸ USP47 Q96K76 1/20 0.36
▸ TGM2 P21980 1/20 0.36
▸ NOTUM Q6P988 1/20 0.36
▸ ELANE P08246 1/20 0.35
▸ PTPRC P08575 1/20 0.34
▸ BCL2 P10415 1/20 0.34
▸ METAP1 P53582 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ LMNA P02545 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
SCHEMBL16682965 0.83 BCHE (0.53) S100A4CES1BCHEELANEPTPRC
SCHEMBL22338139 0.82 S100A4 (0.61) S100A4HSP90AA1CES1BCHETGM2
SCHEMBL24297720 0.82 S100A4 (0.61) S100A4HSP90AA1CES1PPOXITGA1
SCHEMBL27717180 0.81 S100A4 (0.64) S100A4HSP90AA1CES1PPOXITGA1
SCHEMBL15131710 0.81 BCHE (0.55) S100A4CES1BCHEELANEPTPRC
SCHEMBL17637911 0.80 ELANE (0.52) S100A4CES1BCHEUSP8USP7
SCHEMBL1133148 0.79 S100A4 (0.90) S100A4HSP90AA1CES1PPOXITGA1
SCHEMBL30345128 0.79 S100A4 (0.90) S100A4HSP90AA1CES1PPOXITGA1
SCHEMBL29914626 0.77 S100A4 (0.63) S100A4HSP90AA1PPOXITGA1PTPRC
SCHEMBL23294517 0.77 S100A4 (0.63) S100A4HSP90AA1PPOXITGA1PTPRC

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
US-20220123220-A1 COMPOUND AND LIGHT EMITTING ELEMENT USING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2022-04-21 — — US disclosed
WO-2020162156-A1 COMPOUND AND LIGHT EMITTING ELEMENT USING SAME 住友化学株式会社 2020-08-13 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220123220-A1 COMPOUND AND LIGHT EMITTING ELEMENT USING SAME NR2E3, CRY1, GRK1 S100A4 4625/4885HSP90AA1 4247/4885CES1 1825/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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