SCHEMBL20028391

SCHEMBL20028391

C#CCOCc1ccc(-c2nsnc2C(=O)NC(Cc2ccccc2)C(=O)CF)cc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 1/20 0.36
▸ CASP3 P42574 6/20 0.35
▸ MAPT P10636 5/20 0.35
▸ S1PR1 P21453 1/20 0.35
▸ S1PR4 O95977 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ ITGB1 P05556 1/20 0.35
▸ ITGA5 P08648 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ KIFC1 Q9BW19 1/20 0.34
▸ GPR34 Q9UPC5 1/20 0.34
▸ RECQL P46063 1/20 0.33
▸ GHSR Q92847 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
SCHEMBL21854373 1.00 ACE (0.36) ACECASP3MAPTS1PR1S1PR4
SCHEMBL22896350 0.79 CAPN1 (0.46) MAPTS1PR1
SCHEMBL22886464 0.79 ACE (0.42) ACEMAPTS1PR1S1PR4POLB
SCHEMBL22945879 0.73 SCN9A (0.38) ACEPOLBALDH1A1GPR34
SCHEMBL22886426 0.73 FTO (0.42) MAPTPOLBALDH1A1
SCHEMBL20028427 0.73 PYGL (0.41) —
SCHEMBL21410716 0.72 FTO (0.42) MAPTS1PR1POLBALDH1A1
SCHEMBL20028431 0.71 CAPN1 (0.53) —
SCHEMBL21854063 0.71 CAPN1 (0.53) —
SCHEMBL20028577 0.71 CTSL (0.38) CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220324814-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPEUTICS INC (US) 2022-10-13 — — US disclosed
US-11339130-B1 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2022-05-24 — — US disclosed
US-11339130-B1 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2022-05-24 — — US disclosed
US-10934261-B2 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2021-03-02 — — US disclosed
US-10934261-B2 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2021-03-02 — — US disclosed
US-10894776-B2 — — 2021-01-19 — — US disclosed
US-10894776-B2 — — 2021-01-19 — — US disclosed
US-20200123114-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPEUTICS, INC. (US) 2020-04-23 — — US disclosed
WO-2018064119-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPEUTICS, INC. (US) 2018-04-05 — — 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 (5 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-20200123114-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF CAPNS1, CAPN9, CAPN1 ACE 956/4885CASP3 890/4885MAPT 562/4885
US-10934261-B2 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 ACE 956/4885CASP3 890/4885MAPT 562/4885
US-10894776-B2 — CAPNS1, CAPN9, CAPN2 ACE 1164/4885CASP3 1042/4885MAPT 330/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 ACE 956/4885CASP3 890/4885MAPT 562/4885
US-20220324814-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF CAPNS1, CAPN9, CAPN1 ACE 956/4885CASP3 890/4885MAPT 562/4885

“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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