SCHEMBL25758750

SCHEMBL25758750

C=C(NC(C)C)OCC1(Cc2cccc(Cl)c2)CC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.39
GAA P10253 2/20 0.39
SSTR1 P30872 1/20 0.39
SSTR4 P31391 1/20 0.39
MAPT P10636 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
PNMT P11086 1/20 0.38
LMNA P02545 1/20 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
SCHEMBL24019748 0.86 CTSL (0.45) MEN1KMT2AL3MBTL1SSTR1SSTR4
SCHEMBL25759191 0.84 GAA (0.41) MEN1KMT2AL3MBTL1GAASSTR1
SCHEMBL24019715 0.80 MEN1 (0.45) MEN1KMT2AL3MBTL1GAASSTR1
SCHEMBL25758739 0.79 ALDH1A1 (0.52) ALDH1A1HPGDPNMT
SCHEMBL24112711 0.77 MEN1 (0.47) MEN1KMT2AL3MBTL1GAASSTR1
SCHEMBL24112744 0.77 TSHR (0.47) MEN1KMT2AL3MBTL1GAASSTR1
SCHEMBL25852834 0.75 TSHR (0.48) MEN1KMT2AL3MBTL1SSTR1SSTR4
SCHEMBL25759192 0.69 SLC6A4 (0.41) HPGD
SCHEMBL25758752 0.67 KCNA3 (0.46) HPGD
SCHEMBL21937367 0.67 PNMT (0.49) L3MBTL1PNMT

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-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2023-07-06 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-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTRL, CTSL, CTSV MEN1 4306/4885KMT2A 3383/4885L3MBTL1 544/4885

“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.