SCHEMBL2772141

SCHEMBL2772141

CN(CCNC(=S)Nc1ccc(F)cc1F)CCNc1cc(N2CCCC2)nc(N2CCCC2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
KDM4E B2RXH2 3/20 0.40
RAD52 P43351 3/20 0.40
HTT P42858 2/20 0.40
ALDH1A1 P00352 3/20 0.39
GAA P10253 3/20 0.39
HPGD P15428 1/20 0.39
ALOX12 P18054 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
KMT2A Q03164 5/20 0.38
GALR3 O60755 1/20 0.37
NR2F2 P24468 1/20 0.37
RAB9A P51151 1/20 0.37
AKT1 P31749 1/20 0.37
MEN1 O00255 2/20 0.37
GLA P06280 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 3/20 0.36
TP53 P04637 2/20 0.36
APAF1 O14727 1/20 0.36

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
SCHEMBL2773742 0.91 SMN1; SMN2 (0.41) LMNAKDM4ERAD52HTTALDH1A1
SCHEMBL2772283 0.89 KDM4E (0.47) LMNAKDM4ERAD52HTTALDH1A1
SCHEMBL2774140 0.87 RAD52 (0.45) LMNAKDM4ERAD52HTTALDH1A1
SCHEMBL2772650 0.86 RAD52 (0.43) LMNAKDM4ERAD52HTTALDH1A1
SCHEMBL2788028 0.86 MAPT (0.41) LMNAKDM4ERAD52HTTPOLB
SCHEMBL2774380 0.86 RAD52 (0.47) LMNAKDM4ERAD52HTTALDH1A1
SCHEMBL2786331 0.85 KDM4E (0.40) LMNAKDM4ERAD52HTTALDH1A1
SCHEMBL2772691 0.85 HRH4 (0.44) LMNAKDM4ERAD52HTTGAA
SCHEMBL2775656 0.84 RAD52 (0.46) LMNAKDM4ERAD52HTTALDH1A1
SCHEMBL2772754 0.83 ACHE (0.44) LMNAKDM4ERAD52HTTALDH1A1

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-20100137275-A1 TRIAMINOPYRIMIDINE DERIVATIVES AS INHIBITORS OF CDC25 PHOSPHATASE IPSEN PHARMA S.A.S. (FR) 2010-06-03 US claimed
EP-2152675-A1 TRIAMINOPYRIMIDINE DERIVATIVES AS INHIBITORS OF CDC25 PHOSPHATASE IPSEN PHARMA S.A.S. (FR) 2010-02-17 EP claimed
WO-2008152223-A1 TRIAMINOPYRIMIDINE DERIVATIVES AS INHIBITORS OF CDC25 PHOSPHATASE IPSEN PHARMA S.A.S. (FR) 2008-12-18 WO 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 4708/4885KDM4E 2170/4885RAD52 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.