SCHEMBL14358543

SCHEMBL14358543

CC(C)C(=O)Nc1ccc(CCc2ccc(NC(=O)C(C)C)cc2S(=O)(=O)O)c(S(=O)(=O)O)c1.[NaH]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ LMNA P02545 2/20 0.49
▸ CA12 O43570 1/20 0.48
▸ CA1 P00915 1/20 0.48
▸ CA2 P00918 1/20 0.48
▸ CA9 Q16790 1/20 0.48
▸ KMT2A Q03164 4/20 0.47
▸ ALDH1A1 P00352 6/20 0.44
▸ KDM4E B2RXH2 4/20 0.44
▸ GLA P06280 1/20 0.44
▸ MLYCD O95822 1/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ RAD51 Q06609 1/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ ENPP2 Q13822 1/20 0.42
▸ HPGD P15428 2/20 0.41

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
SCHEMBL14361824 0.85 ENPP2 (0.57) SMN1; SMN2CA12CA1CA2CA9
SCHEMBL14358622 0.85 CA12 (0.49) SMN1; SMN2LMNACA12CA1CA2
SCHEMBL14358542 0.84 RAD51 (0.60) SMN1; SMN2LMNACA12CA1CA2
SCHEMBL14361745 0.83 CA12 (0.50) SMN1; SMN2LMNACA12CA1CA2
SCHEMBL14359001 0.80 ENPP2 (0.46) KMT2AMEN1RAD51ENPP2
SCHEMBL14361775 0.79 EGFR (0.42) CA12CA1CA2CA9KMT2A
SCHEMBL14358572 0.79 ENPP2 (0.66) SMN1; SMN2LMNACA12CA1CA2
SCHEMBL14358564 0.79 ENPP2 (0.66) SMN1; SMN2LMNACA12CA1CA2
SCHEMBL14358859 0.79 EPHX2 (0.46) RAD51ENPP2
SCHEMBL22690282 0.79 TAAR1 (0.44) SMN1; SMN2LMNACA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2724156-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASE The Jackson Laboratory (US) 2014-04-30 — — EP claimed
US-20130184342-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASE THE JACKSON LABORATORY (US) 2013-07-18 — — US claimed
WO-2013003112-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASE THE JACKSON LABORATORY (US) 2013-01-03 — — WO 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 SMN1; SMN2 2316/4885LMNA 452/4885CA12 1478/4885
US-10207988-B2 Methods and compositions for treatment of cancer and autoimmune disease BAK1, SSB, MRE11 SMN1; SMN2 2316/4885LMNA 452/4885CA12 1478/4885

“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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