SCHEMBL4855896

SCHEMBL4855896

Cc1ccc(NC(=N)c2cccnc2)cc1C

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.70
NPC1 O15118 6/20 0.61
MAPT P10636 2/20 0.61
KMT2A Q03164 5/20 0.57
MEN1 O00255 4/20 0.57
ALDH1A1 P00352 2/20 0.57
SMN1; SMN2 Q16637 1/20 0.48
KDM4E B2RXH2 2/20 0.47
LMNA P02545 2/20 0.47
ATM Q13315 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
CSF1R P07333 1/20 0.46
GAA P10253 1/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
BRAF P15056 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45

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
SCHEMBL4862311 0.81 RAB9A (0.61) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL14223876 0.78 NPC1 (0.56) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL455628 0.78 NAMPT (0.56) RAB9ANPC1KMT2AALDH1A1SMN1; SMN2
SCHEMBL14223443 0.77 RAB9A (0.48) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL4856199 0.77 CYP11B1 (0.51) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL4863530 0.77 KDM4E (0.59) RAB9ANPC1MAPTKMT2AALDH1A1
SCHEMBL4854662 0.77 KMT2A (0.52) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL4854969 0.77 RAB9A (0.70) RAB9ANPC1MAPTKMT2AMEN1
SCHEMBL1437752 0.76 KCNMA1 (0.52) RAB9AMAPTKMT2AMEN1ALDH1A1
SCHEMBL5594818 0.74 ALDH1A1 (0.54) RAB9ANPC1MAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7365069-B2 Pyrimidone derivatives BEXEL PHARMACEUTICALS INC. (US) 2008-04-29 US disclosed
US-7365069-B2 Pyrimidone derivatives BEXEL PHARMACEUTICALS INC. (US) 2008-04-29 US disclosed
US-7365069-B2 Pyrimidone derivatives BEXEL PHARMACEUTICALS INC. (US) 2008-04-29 US disclosed
US-20040259891-A1 Novel pyrimidon derivatives ORCHID CHEMICAL & PHARMACEUTICALS LIMITED (IN) 2004-12-23 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-20040259891-A1 Novel pyrimidon derivatives TYMS, TPMT, TYMP RAB9A 2079/4885NPC1 1563/4885MAPT 28/4885

“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.