SCHEMBL19322642

SCHEMBL19322642

CC(CS)c1ccc(Cn2ccccc2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 1/20 0.48
▸ NFE2L2 Q16236 1/20 0.48
▸ POLB P06746 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ KLKB1 P03952 7/20 0.38
▸ KLK1 P06870 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ ITGB1 P05556 7/20 0.37
▸ ITGA4 P13612 7/20 0.37

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
SCHEMBL19263412 0.87 KEAP1 (0.49) KEAP1NFE2L2POLBNPSR1KLKB1
SCHEMBL17540820 0.84 POLB (0.54) KEAP1NFE2L2POLBNPSR1KLKB1
SCHEMBL9752787 0.80 POLB (0.63) KEAP1NFE2L2POLBNPSR1KLKB1
SCHEMBL17229327 0.78 POLB (0.50) KEAP1NFE2L2POLBNPSR1KLKB1
SCHEMBL16891381 0.76 POLB (0.54) KEAP1NFE2L2POLBNPSR1KLKB1
SCHEMBL16891528 0.76 MAPT (0.61) KEAP1NFE2L2POLBNPSR1KLKB1
SCHEMBL1768170 0.75 POLB (0.61) POLBNPSR1MAPT
SCHEMBL16881026 0.74 POLB (0.56) KEAP1NFE2L2POLBNPSR1KLKB1
SCHEMBL4591947 0.74 POLB (0.61) POLBNPSR1KLKB1KLK1MAPT
SCHEMBL1240350 0.74 MAPT (0.56) POLBNPSR1KLKB1MAPT

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-9834513-B2 Benzylamine derivatives Kalvista Pharmceuticals Limited (GB) 2017-12-05 — — US disclosed
US-20170253561-A1 Benzylamine Derivatives KALVISTA PHARMACEUTICALS LTD (GB) 2017-09-07 — — US 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-20170253561-A1 Benzylamine Derivatives BDKRB1, BDKRB2, KLKB1 KEAP1 415/4885NFE2L2 2953/4885POLB 3927/4885

“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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