SCHEMBL3953447

SCHEMBL3953447

Cc1nccnc1C(=O)C=CN(C)C

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.50
MAPT P10636 7/20 0.46
CYP1A2 P05177 3/20 0.46
CYP2C19 P33261 2/20 0.46
HPGD P15428 2/20 0.46
ALOX12 P18054 1/20 0.46
RECQL P46063 2/20 0.44
POLB P06746 2/20 0.44
GAA P10253 3/20 0.43
LMNA P02545 3/20 0.43
ALDH1A1 P00352 6/20 0.42
KDM4E B2RXH2 1/20 0.42
RAB9A P51151 4/20 0.42
KMT2A Q03164 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MEN1 O00255 3/20 0.41
NPC1 O15118 2/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL31145321 0.81 ALDH1A1 (0.49) HTTMAPTCYP1A2CYP2C19HPGD
SCHEMBL4816828 0.78 MAPT (0.50) HTTMAPTCYP1A2CYP2C19HPGD
SCHEMBL4816834 0.78 MAPT (0.50) HTTMAPTCYP1A2CYP2C19HPGD
SCHEMBL30600289 0.78 HTT (0.43) HTTMAPTCYP1A2HPGDRECQL
SCHEMBL26081235 0.78 HTT (0.43) HTTMAPTCYP1A2HPGDRECQL
SCHEMBL10921898 0.75 MAPT (0.50) HTTMAPTCYP1A2CYP2C19HPGD
SCHEMBL10921894 0.75 MAPT (0.50) HTTMAPTCYP1A2CYP2C19HPGD
SCHEMBL14033785 0.73 MAPT (0.53) HTTMAPTCYP1A2CYP2C19HPGD
SCHEMBL4912957 0.73 MAPT (0.53) HTTMAPTCYP1A2CYP2C19HPGD
SCHEMBL23841243 0.72 MAPT (0.48) HTTMAPTCYP1A2CYP2C19HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1922309-B1 N-PHENYL-2-PYRIMIDINE-AMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF IL YANG PHARM CO LTD (KR) 2014-05-21 EP disclosed
US-7501424-B2 N-phenyl-2-pyrimidine-amine derivatives and process for the preparation thereof IL-YANG PHARM. CO., LTD. (KR) 2009-03-10 US disclosed
US-20080096899-A1 N-Phenyl-2-Pyrimidine-Amine Derivatives and Process for the Preparation Thereof IL-YANG PHARM. CO., LTD. (KR) 2008-04-24 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 (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-20080096899-A1 N-Phenyl-2-Pyrimidine-Amine Derivatives and Process for the Preparation Thereof ITPA, TYMP, THPO HTT 1992/4885MAPT 638/4885CYP1A2 1077/4885

“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.