SCHEMBL4244136

SCHEMBL4244136

ClCCCOc1cccc(Nc2nccc(Cl)n2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.53
AIMP2 Q13155 1/20 0.49
PRKCD Q05655 2/20 0.49
ROCK2 O75116 1/20 0.49
PRKACA P17612 1/20 0.49
ROCK1 Q13464 1/20 0.49
DYRK1A Q13627 1/20 0.49
CDC42BPA Q5VT25 1/20 0.49
PIK3CG P48736 5/20 0.47
PIK3CA P42336 4/20 0.47
PIK3CB P42338 4/20 0.47
PRKCA P17252 2/20 0.47
MAP3K5 Q99683 1/20 0.47
SYK P43405 4/20 0.46
ABL1 P00519 1/20 0.46
BCR P11274 1/20 0.46
SRC P12931 1/20 0.46
IGF1R P08069 2/20 0.44
AGER Q15109 1/20 0.44
JAK2 O60674 2/20 0.44

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
SCHEMBL13911400 0.86 EGFR (0.49) EGFRAIMP2PRKCDROCK2PRKACA
SCHEMBL7052367 0.83 AGER (0.66) EGFRAIMP2PRKCDROCK2PRKACA
SCHEMBL2115684 0.77 ABL1 (0.62) PRKCDROCK1PRKCASYKABL1
SCHEMBL30847380 0.75 CDK2 (0.55) EGFRPRKCDPRKACADYRK1APIK3CG
SCHEMBL27111928 0.75 CDK2 (0.55) EGFRPRKCDPRKACADYRK1APIK3CG
SCHEMBL14344221 0.74 SYK (0.47) EGFRPRKCDPIK3CGPIK3CAPIK3CB
SCHEMBL14368039 0.74 CDK5 (0.53) EGFRPRKCDPIK3CGPIK3CAPIK3CB
SCHEMBL3439832 0.73 SYK (0.64) PRKCDPIK3CGPRKCASYKABL1
SCHEMBL857880 0.73 AURKA (0.70) EGFRPRKCDROCK1PRKCAABL1
SCHEMBL2064243 0.72 ROCK1 (0.56) EGFRAIMP2PRKCDROCK2PRKACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069360-A1 Organic Compounds CARAVATTI, GIORGIO (CH) 2009-03-12 US disclosed
US-20090069360-A1 Organic Compounds CARAVATTI, GIORGIO (CH) 2009-03-12 US disclosed
US-20090069360-A1 Organic Compounds CARAVATTI, GIORGIO (CH) 2009-03-12 US disclosed
EP-2001864-A1 HETEROCYCLIC ORGANIC COMPOUNDS FOR THE TREATMENT OF IN PARTICULAR MELANOMA Novartis Pharma AG (CH) 2008-12-17 EP disclosed
WO-2007109045-A1 HETEROCYCLIC ORGANIC COMPOUNDS FOR THE TREATMENT OF IN PARTICULAR MELANOMA NOVARTIS AG (CH) 2007-09-27 WO disclosed
WO-2007109045-A1 HETEROCYCLIC ORGANIC COMPOUNDS FOR THE TREATMENT OF IN PARTICULAR MELANOMA NOVARTIS AG (CH) 2007-09-27 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-20090069360-A1 Organic Compounds BRAF, MAP3K1, RAF1 EGFR 169/4885AIMP2 3401/4885PRKCD 1634/4885

“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.