SCHEMBL17138111

SCHEMBL17138111

CCCCCCS(=O)(=O)C(C)N

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA2 P00918 10/20 0.64
FAAH O00519 2/20 0.48
TP53 P04637 1/20 0.47
OPRM1 P35372 1/20 0.41
CES1 P23141 4/20 0.40
CA1 P00915 4/20 0.39
CA9 Q16790 4/20 0.39

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
SCHEMBL14519882 0.81 CA2 (0.63) CA2FAAHTP53CES1
SCHEMBL11101496 0.81 CA2 (0.63) CA2FAAHTP53CES1
SCHEMBL1911477 0.81 CA2 (0.63) CA2FAAHTP53CES1
SCHEMBL27050891 0.81 CA2 (0.63) CA2FAAHTP53CES1
SCHEMBL4005014 0.80
SCHEMBL34463419 0.80 CA2 (0.57) CA2FAAHTP53OPRM1CES1
SCHEMBL7740349 0.80 CA2 (0.57) CA2FAAHTP53OPRM1CES1
SCHEMBL5505478 0.78 CA2 (0.59) CA2FAAHTP53CES1
SCHEMBL13623537 0.78 CA2 (0.59) CA2FAAHCES1
SCHEMBL10707328 0.78 CA2 (0.59) CA2FAAHCES1

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-10730836-B2 Forms of apremilast JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2020-08-04 US disclosed
US-20190106389-A1 NOVEL FORMS OF APREMILAST JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2019-04-11 US disclosed
US-10196355-B2 Forms of apremilast JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2019-02-05 US disclosed
US-20170362175-A1 NOVEL FORMS OF APREMILAST JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2017-12-21 US disclosed
US-9351957-B2 Amorphous form of apremilast CADILA HEALTHCARE LIMITED (IN) 2016-05-31 US disclosed
US-20150283249-A1 AMORPHOUS FORM OF APREMILAST CADILA HEALTHCARE LIMITED (IN) 2015-10-08 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 (5 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-10730836-B2 Forms of apremilast ACE, QDPR, APRT CA2 2076/4885FAAH 1771/4885TP53 4082/4885
US-20150283249-A1 AMORPHOUS FORM OF APREMILAST APRT, MAPT, TNF CA2 1113/4885FAAH 554/4885TP53 2093/4885
US-20170362175-A1 NOVEL FORMS OF APREMILAST MAST4, ACE, APRT CA2 2701/4885FAAH 1916/4885TP53 4449/4885
US-20190106389-A1 NOVEL FORMS OF APREMILAST MAST4, ACE, APRT CA2 2701/4885FAAH 1916/4885TP53 4449/4885
US-10196355-B2 Forms of apremilast ACE, QDPR, APRT CA2 2076/4885FAAH 1771/4885TP53 4082/4885

“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.