SCHEMBL14361580

SCHEMBL14361580

CN(C)S(=O)(=O)Nc1ccc(CCc2ccc(NS(=O)(=O)N(C)C)cc2S(=O)(=O)O)c(S(=O)(=O)O)c1.[NaH]

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 8/20 0.48
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ MAPT P10636 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ AR P10275 1/20 0.40
▸ KIF11 P52732 1/20 0.39
▸ ADRB3 P13945 1/20 0.39
▸ GSTO1 P78417 1/20 0.38

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
SCHEMBL14358811 0.83 EPHX2 (0.43) HPGDALDH1A1HTTSMN1; SMN2
SCHEMBL14361579 0.82 RAD51 (0.48) HPGDMEN1KMT2AALDH1A1HTT
SCHEMBL14358859 0.79 EPHX2 (0.46) ADRB3
SCHEMBL14358444 0.78 ENPP2 (0.56) HPGDMEN1KMT2AALDH1A1HTT
SCHEMBL14358438 0.78 ENPP2 (0.56) HPGDMEN1KMT2AALDH1A1HTT
SCHEMBL11018635 0.76 HPGD (0.49) HPGDMEN1KMT2AALDH1A1HTT
SCHEMBL14361824 0.76 ENPP2 (0.57) HPGDMEN1KMT2AALDH1A1HTT
SCHEMBL14358623 0.75 EPHX2 (0.46) —
SCHEMBL9079841 0.74 EGFR (0.41) HPGDMEN1KMT2AALDH1A1POLB
SCHEMBL14358543 0.73 SMN1; SMN2 (0.49) HPGDMEN1KMT2AALDH1A1HTT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130184342-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASE THE JACKSON LABORATORY (US) 2013-07-18 — — US claimed
US-10207988-B2 Methods and compositions for treatment of cancer and autoimmune disease THE JACKSON LABORATORY (US) 2019-02-19 — — US disclosed
EP-2724156-B1 METHODS AND COMPOSITIONS FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASE JACKSON LAB (US) 2017-08-16 — — EP disclosed
EP-2724156-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASE The Jackson Laboratory (US) 2014-04-30 — — EP disclosed
US-20130184342-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASE THE JACKSON LABORATORY (US) 2013-07-18 — — US disclosed
WO-2013003112-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASE THE JACKSON LABORATORY (US) 2013-01-03 — — WO 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 (2 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-20130184342-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASE BAK1, SSB, MRE11 HPGD 1545/4885MEN1 1722/4885KMT2A 2241/4885
US-10207988-B2 Methods and compositions for treatment of cancer and autoimmune disease BAK1, SSB, MRE11 HPGD 1545/4885MEN1 1722/4885KMT2A 2241/4885

“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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