SCHEMBL1496856

SCHEMBL1496856

CCCNC(=O)NC(CCCN1CCOCC1)c1ccc(C(=O)Nc2cscc2NC(=O)OC(C)(C)C)nc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 1/20 0.41
JAK2 O60674 1/20 0.38
KDM4E B2RXH2 3/20 0.36
GAA P10253 3/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
VDR P11473 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL1496928 0.98 CD274 (0.40) CD274JAK2KDM4EGAAALDH1A1
SCHEMBL3225998 0.94 CD274 (0.41) CD274JAK2KDM4EGAAALDH1A1
SCHEMBL1496891 0.93 FGFR1 (0.38) LMNAKMT2A
SCHEMBL3219036 0.91 CD274 (0.41) CD274JAK2KDM4EGAAALDH1A1
SCHEMBL1496988 0.91 SIGMAR1 (0.39) CD274KDM4EGAAALDH1A1LMNA
SCHEMBL3234115 0.91 CD274 (0.40) CD274JAK2KDM4EGAAALDH1A1
SCHEMBL1497011 0.91 SIGMAR1 (0.41) CD274KDM4EGAAALDH1A1LMNA
SCHEMBL1496874 0.89 SIGMAR1 (0.38) CD274JAK2KDM4EGAAALDH1A1
SCHEMBL1496958 0.89 CD274 (0.39) CD274JAK2HRH3
SCHEMBL1482270 0.87 SMN1; SMN2 (0.36) KDM4EGAAALDH1A1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120202808-A1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE SANTEN PHARMACEUTICAL CO., LTD. (JP) 2012-08-09 US disclosed
EP-2292611-B1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE SANTEN PHARMACEUTICAL CO LTD (JP) 2012-07-25 EP disclosed
EP-2292611-A1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE Santen Pharmaceutical Co., Ltd (JP) 2011-03-09 EP 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 (1 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-20120202808-A1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE CBR1, NAT1, PRMT1 CD274 4096/4885JAK2 1075/4885KDM4E 2885/4885

“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.