SCHEMBL1049412

SCHEMBL1049412

Cc1cccnc1Nc1cc2ccn(Cc3ccccc3)c(=O)c2c(N)n1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
PKM P14618 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
P2RX7 Q99572 14/20 0.41
EGLN1 Q9GZT9 2/20 0.38
BRD4 O60885 1/20 0.38
KLKB1 P03952 1/20 0.38
KLK1 P06870 1/20 0.38
MAPK14 Q16539 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
SCHEMBL1049132 0.86 KDM4E (0.44) KDM4EALDH1A1PKMHPGDHSD17B10
SCHEMBL1050065 0.85 KDM4E (0.43) KDM4EALDH1A1PKMHPGDHSD17B10
SCHEMBL1049396 0.82 ZAP70 (0.39) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL1043427 0.81 BTK (0.43) KDM4EALDH1A1PKMHPGDHSD17B10
SCHEMBL1048380 0.81 KDM4E (0.42) KDM4EALDH1A1PKMHPGDHSD17B10
SCHEMBL1044974 0.80 ALDH1A1 (0.41) KDM4EALDH1A1PKMHPGDHSD17B10
SCHEMBL1047994 0.80 KDM4E (0.41) KDM4EALDH1A1PKMHPGDHSD17B10
SCHEMBL1046657 0.79 KDM4E (0.42) KDM4EALDH1A1PKMHPGDHSD17B10
SCHEMBL27806130 0.77 KDM4E (0.45) KDM4EALDH1A1PKMHPGDHSD17B10
SCHEMBL27806140 0.71 KDM4E (0.42) KDM4EALDH1A1PKMHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US claimed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US claimed
EP-2238137-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-10-13 EP claimed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 WO claimed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US disclosed
EP-2238137-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-10-13 EP disclosed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 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-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FYN, SYK, RET KDM4E 2223/4885ALDH1A1 2562/4885PKM 2173/4885

“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.