SCHEMBL17833665

SCHEMBL17833665

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ USP2 O75604 3/20 0.49
▸ POLB P06746 2/20 0.49
▸ ATM Q13315 1/20 0.49
▸ PLEC Q15149 1/20 0.49
▸ CA1 P00915 14/20 0.47
▸ CA2 P00918 14/20 0.47
▸ CA9 Q16790 14/20 0.47
▸ CA12 O43570 5/20 0.45
▸ ALPL P05186 1/20 0.42
▸ ALPI P09923 1/20 0.42
▸ ALPG P10696 1/20 0.42
▸ CA14 Q9ULX7 3/20 0.41
▸ CA7 P43166 3/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 1/20 0.40

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
SCHEMBL17833664 0.90 USP2 (0.64) MEN1KMT2AUSP2POLBATM
SCHEMBL19788026 0.85 CA9 (0.62) USP2CA1CA2CA9CA12
SCHEMBL16103947 0.82 USP2 (0.62) MEN1KMT2AUSP2POLBATM
SCHEMBL10205352 0.81 POLB (0.47) MEN1KMT2AUSP2POLBATM
SCHEMBL10031014 0.79 USP2 (0.60) MEN1KMT2AUSP2POLBATM
SCHEMBL19817548 0.79 USP2 (0.60) MEN1KMT2AUSP2POLBATM
SCHEMBL9910747 0.78 MEN1 (0.72) MEN1KMT2AUSP2POLBATM
SCHEMBL14510941 0.78 USP2 (0.59) MEN1KMT2AUSP2POLBATM
SCHEMBL10035689 0.78 USP2 (0.59) MEN1KMT2AUSP2POLBATM
SCHEMBL14044262 0.76 USP2 (0.77) MEN1KMT2AUSP2POLBATM

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 MEN1 1476/4885KMT2A 558/4885USP2 2489/4885

“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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