SCHEMBL9942091

SCHEMBL9942091

O=S(=O)(Nc1ccncc1)c1ccc2ccccc2c1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.68
▸ PGR P06401 1/20 0.64
▸ F2 P00734 1/20 0.62
▸ LMNA P02545 2/20 0.61
▸ SMN1; SMN2 Q16637 2/20 0.61
▸ ALDH1A1 P00352 4/20 0.61
▸ GAA P10253 1/20 0.61
▸ PKM P14618 1/20 0.60
▸ PKLR P30613 1/20 0.60
▸ KMT2A Q03164 5/20 0.59
▸ MEN1 O00255 4/20 0.59
▸ AKT1 P31749 1/20 0.56
▸ GLO1 Q04760 1/20 0.56
▸ TDP1 Q9NUW8 1/20 0.56
▸ MAPT P10636 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ PIK3CB P42338 1/20 0.55
▸ HSD11B1 P28845 1/20 0.55
▸ PLAU P00749 2/20 0.54

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
SCHEMBL14324281 0.89 ALDH1A1 (0.61) ATMPGRF2LMNASMN1; SMN2
SCHEMBL29549847 0.86 PGR (0.77) ATMPGRLMNASMN1; SMN2ALDH1A1
SCHEMBL20021987 0.86 PGR (0.77) ATMPGRLMNASMN1; SMN2ALDH1A1
SCHEMBL28396503 0.86 PGR (0.77) ATMPGRLMNASMN1; SMN2ALDH1A1
SCHEMBL6560346 0.83 KMT2A (0.62) ATMPGRLMNASMN1; SMN2ALDH1A1
SCHEMBL28424632 0.81 F2 (0.57) ATMPGRF2LMNASMN1; SMN2
SCHEMBL28424629 0.81 F2 (0.57) ATMPGRF2LMNASMN1; SMN2
SCHEMBL20021984 0.81 ATM (0.72) ATMPGRLMNASMN1; SMN2ALDH1A1
SCHEMBL808105 0.81 ATM (0.72) ATMPGRLMNASMN1; SMN2ALDH1A1
SCHEMBL9942088 0.81 ATM (0.72) ATMPGRLMNASMN1; SMN2ALDH1A1

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-20120148604-A1 TRP INHIBITORS AND USES THEREOF TRANSPOSAGEN BIOPHARMACEUTICALS, INC. (US) 2012-06-14 — — 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-20120148604-A1 TRP INHIBITORS AND USES THEREOF TRPC4, TRPC1, TRPC3 ATM 4440/4885PGR 4624/4885F2 4802/4885

“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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