SCHEMBL14358668

SCHEMBL14358668

COCC(=O)Nc1ccc(CCc2ccc(NC(=O)COC)cc2S(=O)(=O)O)c(S(=O)(=O)O)c1.[NaH]

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ HPGD P15428 6/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ KDM4C Q9H3R0 1/20 0.49
▸ MAPT P10636 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ ALOX12 P18054 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ KMT2A Q03164 2/20 0.45
▸ LMNA P02545 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ MTNR1A P48039 1/20 0.43
▸ MTNR1B P49286 1/20 0.43
▸ RAD51 Q06609 1/20 0.43

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
SCHEMBL15116962 0.89 KDM4E (0.44) KDM4EL3MBTL1HPGDALDH1A1KDM4C
SCHEMBL14358661 0.85 RAD51 (0.59) KDM4EL3MBTL1HPGDALDH1A1KDM4C
SCHEMBL14361824 0.81 ENPP2 (0.57) L3MBTL1HPGDALDH1A1MAPTSMN1; SMN2
SCHEMBL14361795 0.81 ENPP2 (0.61) KDM4EL3MBTL1HPGDALDH1A1KDM4C
SCHEMBL15105399 0.81 ENPP2 (0.61) KDM4EL3MBTL1HPGDALDH1A1KDM4C
SCHEMBL10802549 0.80 HPGD (0.51) KDM4EL3MBTL1HPGDALDH1A1KDM4C
SCHEMBL14358543 0.79 SMN1; SMN2 (0.49) KDM4EHPGDALDH1A1MAPTSMN1; SMN2
SCHEMBL14358475 0.77 ENPP2 (0.70) KDM4EL3MBTL1HPGDALDH1A1KDM4C
SCHEMBL14358468 0.77 ENPP2 (0.70) KDM4EL3MBTL1HPGDALDH1A1KDM4C
SCHEMBL14358783 0.77 ENPP2 (0.53) KDM4EL3MBTL1HPGDALDH1A1KDM4C

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 KDM4E 2402/4885L3MBTL1 806/4885HPGD 1545/4885
US-10207988-B2 Methods and compositions for treatment of cancer and autoimmune disease BAK1, SSB, MRE11 KDM4E 2402/4885L3MBTL1 806/4885HPGD 1545/4885

“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.

Send feedback