SCHEMBL2774074

SCHEMBL2774074

CN(CCNC(=S)Nc1ccc(Cl)cc1)CCNc1cc(N2CCC2)nc(N2CCC2)n1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
POLB P06746 1/20 0.48
RAD52 P43351 7/20 0.45
KDM4E B2RXH2 6/20 0.45
HTT P42858 3/20 0.45
KMT2A Q03164 5/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 2/20 0.41
GLA P06280 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
ACHE P22303 1/20 0.39
HPGD P15428 1/20 0.38
GBA1 P04062 1/20 0.38

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
SCHEMBL2773495 0.98 LMNA (0.48) LMNAPOLBRAD52KDM4EHTT
Hydrochloric Acid SCHEMBL2791558 0.97 LMNA (0.47) LMNAPOLBRAD52KDM4EHTT
SCHEMBL2774112 0.97 LMNA (0.47) LMNAPOLBRAD52KDM4EHTT
SCHEMBL2772135 0.92 KMT2A (0.52) LMNAPOLBKDM4EHTTKMT2A
SCHEMBL2772076 0.89 RAD52 (0.47) LMNARAD52KDM4EHTTKMT2A
SCHEMBL2774351 0.89 KDM4E (0.47) LMNAPOLBRAD52KDM4EHTT
SCHEMBL2772283 0.89 KDM4E (0.47) LMNAPOLBRAD52KDM4EHTT
SCHEMBL2773128 0.88 RAD52 (0.44) LMNAPOLBRAD52KDM4EHTT
SCHEMBL2772132 0.88 GALR2 (0.49) LMNARAD52KDM4EHTTKMT2A
SCHEMBL2774380 0.88 RAD52 (0.47) LMNARAD52KDM4EHTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137275-A1 TRIAMINOPYRIMIDINE DERIVATIVES AS INHIBITORS OF CDC25 PHOSPHATASE IPSEN PHARMA S.A.S. (FR) 2010-06-03 US claimed
US-20100137275-A1 TRIAMINOPYRIMIDINE DERIVATIVES AS INHIBITORS OF CDC25 PHOSPHATASE IPSEN PHARMA S.A.S. (FR) 2010-06-03 US disclosed
EP-2152675-A1 TRIAMINOPYRIMIDINE DERIVATIVES AS INHIBITORS OF CDC25 PHOSPHATASE IPSEN PHARMA S.A.S. (FR) 2010-02-17 EP disclosed
WO-2008152223-A1 TRIAMINOPYRIMIDINE DERIVATIVES AS INHIBITORS OF CDC25 PHOSPHATASE IPSEN PHARMA S.A.S. (FR) 2008-12-18 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 (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-20100137275-A1 TRIAMINOPYRIMIDINE DERIVATIVES AS INHIBITORS OF CDC25 PHOSPHATASE CDC25A, CDC25B, CDC25C LMNA 4708/4885POLB 983/4885RAD52 325/4885

“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.