SCHEMBL5524909

SCHEMBL5524909

Cc1ccc(Nc2ncc(CCC(C)N(C)C)c(N)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.43
CDK2 P24941 2/20 0.39
CCNA2 P20248 1/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39
NPC1 O15118 2/20 0.38
KCNH2 Q12809 1/20 0.38
SCN5A Q14524 1/20 0.38
SCN9A Q15858 1/20 0.38
AURKA O14965 3/20 0.38
MAPT P10636 3/20 0.37
JAK2 O60674 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
CDK1 P06493 1/20 0.36
KDR P35968 1/20 0.36
CDK4 P11802 1/20 0.35
KCNH3 Q9ULD8 1/20 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
SCHEMBL5534559 0.91 NPC1 (0.49) RAB9ACDK2NPC1KCNH2SCN5A
SCHEMBL5522579 0.89 SCN9A (0.44) RAB9ACDK2CCNA2NPC1KCNH2
SCHEMBL5527171 0.88 L3MBTL1 (0.47) RAB9ANPC1MAPTJAK2MEN1
SCHEMBL5533574 0.84 MEN1 (0.43) RAB9ANPC1MAPTMEN1ALDH1A1
SCHEMBL5522571 0.84 RAB9A (0.41) RAB9ANPC1SCN9AMEN1ALDH1A1
SCHEMBL2114974 0.83 RAB9A (0.47) RAB9ACDK2CCNA2CDK5CDK5R1
SCHEMBL5529511 0.82 TNK2 (0.35) MAPTHDAC6KMT2ADHFR
SCHEMBL5529329 0.81 HTT (0.45) RAB9ACDK2CCNA2CDK5CDK5R1
SCHEMBL5522576 0.81 KMT2A (0.43) RAB9ACDK2NPC1MAPTCYP1A2
SCHEMBL2111997 0.81 RAB9A (0.45) RAB9ACDK2CCNA2CDK5CDK5R1

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 1 patent. 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

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-20070293525-A1 2-ANILINO-4-AMINOALKYLENEAMINOPYRIMIDINES PRKCA, PRKCH, PRKCG RAB9A 2884/4885CDK2 69/4885CCNA2 855/4885

“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.