SCHEMBL2114726

SCHEMBL2114726

CN(C)CCCc1cnc(Nc2cccc(Cl)c2Cl)nc1N

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
PLK1 P53350 3/20 0.40
TNK2 Q07912 2/20 0.40
SLC6A4 P31645 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
FGFR1 P11362 2/20 0.37
CSF1R P07333 2/20 0.37
PTPN11 Q06124 2/20 0.36
KDR P35968 4/20 0.36
CDK1 P06493 2/20 0.36
WEE1 P30291 1/20 0.36
KCNH2 Q12809 1/20 0.36
PDGFRB P09619 2/20 0.35
PLK3 Q9H4B4 2/20 0.35
KIT P10721 1/20 0.35
FLT3 P36888 1/20 0.35
IGF1R P08069 2/20 0.35

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
SCHEMBL2113363 0.97 LMNA (0.47) LMNAPLK1TNK2SLC6A4MEN1
SCHEMBL2114807 0.93 LMNA (0.50) LMNATNK2MEN1KMT2ACSF1R
SCHEMBL2113595 0.91 IGF1R (0.44) PLK1TNK2SLC6A4FGFR1KDR
SCHEMBL2113295 0.88 IGF1R (0.43) PLK1TNK2IGF1R
SCHEMBL2113867 0.87 TNK2 (0.46) PLK1TNK2SLC6A4FGFR1KDR
SCHEMBL2114805 0.84 TNK2 (0.46) TNK2SLC6A4FGFR1KDRCDK1
SCHEMBL2115650 0.84 IGF1R (0.46) TNK2KDRCDK1IGF1R
SCHEMBL2116828 0.83 HTT (0.43) LMNAPLK1TNK2KMT2AIGF1R
SCHEMBL2115703 0.83 HTT (0.47) LMNATNK2KMT2A
SCHEMBL5535331 0.83 LMNA (0.46) LMNAMEN1KMT2APTPN11IGF1R

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-20070293525-A1 2-ANILINO-4-AMINOALKYLENEAMINOPYRIMIDINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-12-20 US claimed
US-8158641-B2 2-anilino-4-aminoalkyleneaminopyrimidines BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-04-17 US disclosed
US-20090181995-A1 2-ANILINO-4-AMINOALKYLENEAMINOPYRIMIDINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-07-16 US disclosed
US-20070293525-A1 2-ANILINO-4-AMINOALKYLENEAMINOPYRIMIDINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-12-20 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 (2 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-20070293525-A1 2-ANILINO-4-AMINOALKYLENEAMINOPYRIMIDINES PRKCA, PRKCH, PRKCG LMNA 975/4885PLK1 644/4885TNK2 195/4885
US-20090181995-A1 2-ANILINO-4-AMINOALKYLENEAMINOPYRIMIDINES PRKCA, PRKCH, PRKCG LMNA 975/4885PLK1 644/4885TNK2 195/4885

“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.