SCHEMBL17833664

SCHEMBL17833664

CNC(=S)Nc1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)cc1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 3/20 0.64
▸ MEN1 O00255 2/20 0.64
▸ POLB P06746 2/20 0.64
▸ KMT2A Q03164 2/20 0.64
▸ ATM Q13315 1/20 0.64
▸ PLEC Q15149 1/20 0.64
▸ CA1 P00915 16/20 0.57
▸ CA2 P00918 16/20 0.57
▸ CA9 Q16790 16/20 0.57
▸ CA12 O43570 7/20 0.55
▸ ALPL P05186 1/20 0.54
▸ ALPI P09923 1/20 0.54
▸ ALPG P10696 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ CA14 Q9ULX7 3/20 0.51
▸ CA7 P43166 3/20 0.51
▸ DNASE1L3 Q13609 1/20 0.47
▸ PRMT1 Q99873 1/20 0.47

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
SCHEMBL16103947 0.93 USP2 (0.62) USP2MEN1POLBKMT2AATM
SCHEMBL17833665 0.90 MEN1 (0.49) USP2MEN1POLBKMT2AATM
SCHEMBL10031014 0.89 USP2 (0.60) USP2MEN1POLBKMT2AATM
SCHEMBL19817548 0.89 USP2 (0.60) USP2MEN1POLBKMT2AATM
SCHEMBL14510941 0.88 USP2 (0.59) USP2MEN1POLBKMT2AATM
SCHEMBL10035689 0.88 USP2 (0.59) USP2MEN1POLBKMT2AATM
SCHEMBL13097493 0.85 CA9 (0.75) USP2CA1CA2CA9CA12
SCHEMBL19705803 0.83 CA1 (0.54) USP2MEN1POLBKMT2AATM
SCHEMBL19958456 0.83 CA1 (0.54) USP2MEN1POLBKMT2AATM
SCHEMBL19817547 0.82 CA1 (0.59) USP2MEN1POLBKMT2AATM

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-20160166679-A1 METHOD OF TREATMENT USING FOLATE CONJUGATES AND TYROSINE KINASE INHIBITORS PURDUE RESEARCH FOUNDATION 2016-06-16 — — 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-20160166679-A1 METHOD OF TREATMENT USING FOLATE CONJUGATES AND TYROSINE KINASE INHIBITORS DHFR, FOLR1, FER USP2 2489/4885MEN1 1476/4885POLB 1979/4885

“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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