SCHEMBL22886430

SCHEMBL22886430

Cc1cc(-c2nsnc2C(=O)NC(Cc2ccccc2)C(O)C(N)=O)c(C)o1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PYGL P06737 10/20 0.41
▸ CCR1 P32246 2/20 0.35
▸ RAB9A P51151 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ EGLN2 Q96KS0 2/20 0.34
▸ EGLN1 Q9GZT9 2/20 0.34
▸ THRB P10828 1/20 0.34
▸ HPGDS O60760 2/20 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
SCHEMBL22886004 0.85 CAPN1 (0.48) KMT2A
SCHEMBL22886638 0.82 PYGL (0.43) PYGLCCR1RAB9AKMT2AMEN1
SCHEMBL22886609 0.82 PYGL (0.45) PYGLCCR1EGLN2EGLN1HPGDS
SCHEMBL20028423 0.78 CDC7 (0.42) PYGLCCR1HPGDS
SCHEMBL20028429 0.77 PYGL (0.42) PYGLCCR1KMT2AHPGDS
SCHEMBL20028432 0.77 PYGL (0.37) PYGLCCR1RAB9ATHRB
SCHEMBL20028427 0.76 PYGL (0.41) PYGLCCR1EGLN2EGLN1HPGDS
SCHEMBL20028424 0.75 PYGL (0.40) PYGLCCR1HPGDS
SCHEMBL22886421 0.74 PYGL (0.38) PYGLCCR1RAB9AKMT2AMEN1
SCHEMBL22886770 0.73 PYGL (0.38) PYGLCCR1RAB9AEGLN2EGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210009564-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPERTICS INC (US) 2021-01-14 — — 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-20210009564-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF CAPNS1, CAPN9, CAPN1 PYGL 719/4885CCR1 3791/4885RAB9A 1960/4885

“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.

Send feedback