SCHEMBL15328868

SCHEMBL15328868

Cc1c(C(=O)C=CN(C)C)ncn1C

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
KMT2A Q03164 3/20 0.43
HTT P42858 2/20 0.42
POLB P06746 3/20 0.41
RECQL P46063 2/20 0.41
ALDH1A1 P00352 5/20 0.41
LMNA P02545 4/20 0.41
RAB9A P51151 3/20 0.41
MEN1 O00255 2/20 0.41
GAA P10253 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 3/20 0.39
CYP2C19 P33261 2/20 0.39
HPGD P15428 2/20 0.39
ALOX12 P18054 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL15340726 1.00 MAPT (0.44) MAPTSMN1; SMN2KMT2AHTTPOLB
SCHEMBL3953447 0.71 HTT (0.50) MAPTSMN1; SMN2KMT2AHTTPOLB
SCHEMBL5725359 0.71 APOBEC3A (0.42) MAPTKMT2APOLBALDH1A1LMNA
SCHEMBL5726080 0.71 BCAT2 (0.44) KMT2AHTTLMNAMEN1GAA
SCHEMBL15601778 0.70 LMNA (0.46) KMT2AALDH1A1LMNAMEN1KDM4E
SCHEMBL5725541 0.69 APOBEC3A (0.41) ALDH1A1
SCHEMBL5350341 0.69 POLB (0.49) MAPTSMN1; SMN2KMT2AHTTPOLB
SCHEMBL6103800 0.69 HTT (0.47) MAPTSMN1; SMN2KMT2AHTTPOLB
SCHEMBL6103804 0.69 HTT (0.47) MAPTSMN1; SMN2KMT2AHTTPOLB
SCHEMBL15340721 0.69 RECQL (0.46) MAPTSMN1; SMN2KMT2AHTTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2838895-B1 AMINO-INDOLYL-SUBSTITUTED IMIDAZOLYL-PYRIMIDINES AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INT (DE) 2016-07-13 EP disclosed
US-9096579-B2 Amino-indolyl-substituted imidazolyl-pyrimidines and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-08-04 US disclosed
EP-2838895-A1 AMINO-INDOLYL-SUBSTITUTED IMIDAZOLYL-PYRIMIDINES AND THEIR USE AS MEDICAMENTS Boehringer Ingelheim International GmbH (DE) 2015-02-25 EP disclosed
US-20130281430-A1 Amino-Indolyl-Substituted Imidazolyl-Pyrimidines and Their Use as Medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-24 US disclosed
WO-2013156608-A1 AMINO-INDOLYL-SUBSTITUTED IMIDAZOLYL-PYRIMIDINES AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-24 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-20130281430-A1 Amino-Indolyl-Substituted Imidazolyl-Pyrimidines and Their Use as Medicaments INMT, IDO1, CHRM1 MAPT 1321/4885SMN1; SMN2 1502/4885KMT2A 3310/4885

“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.