SCHEMBL14358564

SCHEMBL14358564

CC(C)C(=O)Nc1ccc(/C=C/c2ccc(NC(=O)C(C)C)cc2S(=O)(=O)O)c(S(=O)(=O)O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.66
SMN1; SMN2 Q16637 5/20 0.52
LMNA P02545 2/20 0.52
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 0.45
RAB9A P51151 5/20 0.45
KDM4E B2RXH2 4/20 0.45
NPC1 O15118 4/20 0.45
CASP3 P42574 2/20 0.45
SENP7 Q9BQF6 2/20 0.45
GLA P06280 1/20 0.44
MEN1 O00255 3/20 0.44
RAD51 Q06609 3/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
MAPT P10636 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
SCHEMBL14358572 1.00 ENPP2 (0.66) ENPP2SMN1; SMN2LMNACA12CA1
SCHEMBL14358452 0.95 ENPP2 (0.76) ENPP2SMN1; SMN2LMNACA12CA1
SCHEMBL14358458 0.95 ENPP2 (0.76) ENPP2SMN1; SMN2LMNACA12CA1
SCHEMBL14358766 0.93 ENPP2 (0.59) ENPP2SMN1; SMN2LMNACA12CA1
SCHEMBL14358764 0.93 ENPP2 (0.59) ENPP2SMN1; SMN2LMNACA12CA1
SCHEMBL14359309 0.92 ENPP2 (0.57) ENPP2SMN1; SMN2LMNACA12CA1
SCHEMBL14358907 0.92 ENPP2 (0.57) ENPP2SMN1; SMN2LMNACA12CA1
SCHEMBL14358620 0.91 ENPP2 (0.63) ENPP2SMN1; SMN2LMNACA12CA1
SCHEMBL14358616 0.91 ENPP2 (0.63) ENPP2SMN1; SMN2LMNACA12CA1
SCHEMBL15105394 0.91 ENPP2 (0.56) ENPP2SMN1; SMN2LMNACA12CA1

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 ENPP2 100/4885SMN1; SMN2 2316/4885LMNA 452/4885
US-10207988-B2 Methods and compositions for treatment of cancer and autoimmune disease BAK1, SSB, MRE11 ENPP2 100/4885SMN1; SMN2 2316/4885LMNA 452/4885

“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.