SCHEMBL933805

SCHEMBL933805

CN(C)CCNc1nc[c]cn1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.44
HRH3 Q9Y5N1 1/20 0.41
DNM2 P50570 10/20 0.41
MKNK1 Q9BUB5 2/20 0.38
HRH4 Q9H3N8 1/20 0.38
GAA P10253 1/20 0.38
ALPG P10696 1/20 0.38
MKNK2 Q9HBH9 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL932370 0.89 NPC1 (0.41) DNM2
SCHEMBL5622381 0.79 ALDH1A1 (0.62) CYP2C19HRH3DNM2MKNK1HRH4
SCHEMBL13733509 0.74 HRH3 (0.47) CYP2C19HRH3DNM2MKNK1HRH4
SCHEMBL12633603 0.74 CYP2C19 (0.43) CYP2C19HRH3DNM2MKNK1HRH4
SCHEMBL9960367 0.74 EGFR (0.44) CYP2C19HRH3DNM2MKNK1HRH4
SCHEMBL11463729 0.74 CYP2C19 (0.43) CYP2C19HRH3DNM2MKNK1HRH4
SCHEMBL933094 0.74 CYP2C19 (0.56) CYP2C19HRH3DNM2HRH4GAA
SCHEMBL18239960 0.73 DNM2 (0.47) CYP2C19HRH3DNM2
SCHEMBL2068138 0.72
SCHEMBL5596454 0.71 CYP2C19 (0.44) CYP2C19HRH3DNM2MKNK1HRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3072890-B1 Pyrimidinyl and 1,3,5-triazinyl benzimidazoles and their use in cancer therapy MEI PHARMA INC (US) 2018-10-17 EP disclosed
EP-3072890-A1 Pyrimidinyl and 1,3,5-triazinyl benzimidazoles and their use in cancer therapy MEI Pharma, Inc. (US) 2016-09-28 EP disclosed
US-8486939-B2 Pyrimidinyl and 1,3,5-triazinyl benzimidazoles and their use in cancer therapy PATHWAY THERAPEUTICS INC. (US) 2013-07-16 US disclosed
EP-2532659-A1 Pyrimidinyl and 1,3,5-triazinyl benzimidazoles and their use in cancer therapy Pathway Therapeutics, Inc. (US) 2012-12-12 EP disclosed
EP-2451802-A1 PYRIMIDINYL AND 1,3,5-TRIAZINYL BENZIMIDAZOLES AND THEIR USE IN CANCER THERAPY Pathway Therapeutics, Inc. (US) 2012-05-16 EP disclosed
US-20110009405-A1 PYRIMIDINYL AND 1,3,5-TRIAZINYL BENZIMIDAZOLES AND THEIR USE IN CANCER THERAPY PATHWAY THERAPEUTICS LIMITED (NZ) 2011-01-13 US disclosed
WO-2011005119-A1 PYRIMIDINYL AND 1,3,5-TRIAZINYL BENZIMIDAZOLES AND THEIR USE IN CANCER THERAPY PATHWAY THERAPEUTICS LIMITED (NZ) 2011-01-13 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-20110009405-A1 PYRIMIDINYL AND 1,3,5-TRIAZINYL BENZIMIDAZOLES AND THEIR USE IN CANCER THERAPY TYMP, TYMS, CCNI CYP2C19 180/4885HRH3 3114/4885DNM2 3182/4885

“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.