SCHEMBL4132365

SCHEMBL4132365

O=C(Cc1ccccc1)Nc1cnc(-c2ccccc2)nc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 2/20 0.49
CDK2 P24941 2/20 0.49
CDK5 Q00535 2/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
KDM6B O15054 1/20 0.47
KDM4D Q6B0I6 1/20 0.47
KDM4C Q9H3R0 1/20 0.47
HPGD P15428 2/20 0.47
BCHE P06276 1/20 0.47
ELOVL1 Q9BW60 1/20 0.46
DEGS1 O15121 1/20 0.46
ALDH1A1 P00352 1/20 0.46
WNT3A P56704 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
TSHR P16473 1/20 0.46
RIPK1 Q13546 1/20 0.45
EPHX2 P34913 1/20 0.45
GALR3 O60755 1/20 0.45
HTT P42858 1/20 0.45

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
Hydrochloric Acid SCHEMBL4141946 0.81 PDE4B (0.48) CCNE1CDK2CDK5MEN1KMT2A
SCHEMBL4141440 0.81 NPC1 (0.50) RAB9ASMN1; SMN2
SCHEMBL4144446 0.81 ADORA3 (0.48) MEN1KMT2AHPGDALDH1A1ADORA3
Hydrochloric Acid SCHEMBL4144562 0.80 EGLN1 (0.47) CCNE1CDK2CDK5MEN1KMT2A
SCHEMBL4132392 0.80 MEN1 (0.52) CCNE1CDK2CDK5MEN1KMT2A
SCHEMBL4132347 0.80 CCNE1 (0.51) CCNE1CDK2CDK5MEN1KMT2A
SCHEMBL4144040 0.80 LMNA (0.54) CCNE1CDK2CDK5MEN1KMT2A
SCHEMBL4132373 0.76 ADORA3 (0.47) MEN1KMT2AHPGDALDH1A1ADORA3
SCHEMBL4144499 0.73 PDE4B (0.45) CCNE1CDK2CDK5MEN1KMT2A
SCHEMBL9092418 0.73 BCHE (0.49) BCHEALDH1A1GALR3HTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090005560-A1 PRODUCTION METHOD OF DIAMINOPYRIMIDINE COMPOUNDS AJINOMOTO CO. INC (JP) 2009-01-01 US disclosed
EP-2009003-A1 Production method of diaminopyrimidine compounds Ajinomoto Co., Inc. (JP) 2008-12-31 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-20090005560-A1 PRODUCTION METHOD OF DIAMINOPYRIMIDINE COMPOUNDS DPYD, DHPS, UMPS CCNE1 1745/4885CDK2 286/4885CDK5 461/4885

“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.