SCHEMBL24209793

SCHEMBL24209793

O=C(CSc1nnnn1-c1ccc(C(=O)O)cc1)Nc1nc(-c2ccccc2)cs1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.64
▸ KMT2A Q03164 7/20 0.64
▸ LMNA P02545 5/20 0.64
▸ MAPT P10636 5/20 0.64
▸ TSHR P16473 2/20 0.64
▸ CYP1A2 P05177 2/20 0.63
▸ CYP3A4 P08684 2/20 0.63
▸ CYP2C19 P33261 2/20 0.63
▸ POLB P06746 2/20 0.62
▸ APEX1 P27695 1/20 0.62
▸ RAB9A P51151 1/20 0.62
▸ TDP1 Q9NUW8 1/20 0.62
▸ USP2 O75604 2/20 0.61
▸ GLA P06280 1/20 0.61
▸ NPSR1 Q6W5P4 1/20 0.60
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ ALDH1A1 P00352 2/20 0.58
▸ RECQL P46063 1/20 0.58
▸ NOD2 Q9HC29 1/20 0.58
▸ NFKB1 P19838 1/20 0.56

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
SCHEMBL24209795 0.92 KMT2A (0.76) MEN1KMT2ALMNAMAPTTSHR
SCHEMBL24210088 0.81 KMT2A (0.83) MEN1KMT2ALMNAMAPTCYP1A2
SCHEMBL24209702 0.80 MEN1 (0.63) MEN1KMT2ALMNAMAPTTSHR
SCHEMBL8045514 0.79 HPGD (0.54) MEN1KMT2ALMNAMAPTTSHR
SCHEMBL24209779 0.79 KMT2A (0.76) MEN1KMT2ALMNAMAPTCYP1A2
SCHEMBL24210195 0.77 KMT2A (0.73) MEN1KMT2ALMNATSHRCYP1A2
SCHEMBL24209876 0.77 KMT2A (0.83) MEN1KMT2ATSHRPOLBUSP2
SCHEMBL24209696 0.77 NPSR1 (0.67) MEN1KMT2ALMNATSHRCYP1A2
SCHEMBL24019583 0.77 NPSR1 (0.64) MEN1KMT2AMAPTTSHRCYP1A2
SCHEMBL24209727 0.76 HPGD (0.67) MEN1KMT2ALMNAMAPTTSHR

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-20220016080-A1 COMPOUNDS THAT SELECTIVELY AND EFFECTIVELY INHIBIT HAKAI-MEDIATED UBIQUITINATION, AS ANTI-CANCER DRUGS FUND PROFESOR NOVOA SANTOS (ES) 2022-01-20 — — 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-20220016080-A1 COMPOUNDS THAT SELECTIVELY AND EFFECTIVELY INHIBIT HAKAI-MEDIATED UBIQUITINATION, AS ANTI-CANCER DRUGS CHUK, HIPK3, HIPK1 MEN1 3702/4885KMT2A 2532/4885LMNA 4381/4885

“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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