SCHEMBL933094

SCHEMBL933094

CN(C)CCNc1cc[c]cn1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.56
HRH3 Q9Y5N1 1/20 0.47
DNM2 P50570 10/20 0.45
HRH4 Q9H3N8 1/20 0.44
TDO2 P48775 1/20 0.40
MAP4K4 O95819 1/20 0.39
EGLN2 Q96KS0 1/20 0.38
GAA P10253 1/20 0.38
ALPG P10696 1/20 0.38
NCF1 P14598 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
SCHEMBL995044 0.90 CYP2C19 (0.45) CYP2C19HRH3DNM2EGLN2
SCHEMBL991740 0.80 HCAR3 (0.44) CYP2C19DNM2
SCHEMBL4776276 0.77 HCAR3 (0.46) DNM2HRH4MAP4K4
SCHEMBL4777990 0.77 CHEK1 (0.37) HRH3HRH4MAP4K4
SCHEMBL182723 0.77 KDM4E (0.42) CYP2C19TDO2MAP4K4GAA
SCHEMBL182952 0.76 HCAR3 (0.48) CYP2C19NCF1
SCHEMBL2067353 0.76
SCHEMBL933805 0.74 CYP2C19 (0.44) CYP2C19HRH3DNM2HRH4GAA
SCHEMBL1110183 0.74 CYP2C19 (0.49) CYP2C19HRH3DNM2HRH4TDO2
SCHEMBL27453738 0.74 HRH3 (0.47) HRH3HRH4

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.