SCHEMBL3182702

SCHEMBL3182702

CCCc1ccc(NC(=O)Nc2ccc(Oc3ccncc3)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.60
RAB9A P51151 2/20 0.60
RAF1 P04049 8/20 0.57
MAPK13 O15264 1/20 0.55
RIPK2 O43353 1/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
NPC1 O15118 1/20 0.52
CASP3 P42574 1/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
SENP6 Q9GZR1 1/20 0.52
KDR P35968 2/20 0.52
MAPK14 Q16539 2/20 0.52
BRAF P15056 1/20 0.52
TNNI3K Q59H18 1/20 0.52
ABCG2 Q9UNQ0 1/20 0.52
PSMB5 P28074 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.49

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
SCHEMBL3187673 0.89 RAB9A (0.77) MAPTRAB9ARAF1MAPK13RIPK2
SCHEMBL3182747 0.85 NPY5R (0.49) MAPTRAB9ARAF1MAPK13MEN1
SCHEMBL3166920 0.84 MAPT (0.68) MAPTRAB9ARAF1MEN1KMT2A
SCHEMBL3171767 0.83 RAF1 (0.60) MAPTRAB9ARAF1MAPK13RIPK2
SCHEMBL15093809 0.82 HRH3 (0.65) RAB9AMEN1KMT2ANPC1CASP3
SCHEMBL3176437 0.81 RAF1 (0.64) RAB9ARAF1MAPK13RIPK2MEN1
SCHEMBL4127845 0.81 SAE1 (0.73) MAPTRAB9AMEN1KMT2ANPC1
SCHEMBL15574735 0.80 RAB9A (0.63) RAB9AKMT2AGAAHTT
SCHEMBL4117832 0.80 MAPT (0.69) MAPTRAB9AMEN1KMT2ANPC1
SCHEMBL937764 0.80 RAF1 (0.66) MAPTRAB9ARAF1MAPK13RIPK2

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-7652022-B2 N-(4-(4-(4-hydroxyphenylamino)-pyrimidin-6-yl)-oxyphenyl)-N'-(3-trifluoromethylphenyl)-urea; NOVARTIS AG (CH) 2010-01-26 US claimed
EP-1511730-B8 DIARYL UREA DERIVATIVES USEFUL FOR THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES NOVARTIS AG (CH) 2009-04-08 EP claimed
US-20060128734-A1 Diaryl urea derivatives useful for the treatment of protein kinase dependent diseases FLOERSHEIMER ANDREAS 2006-06-15 US claimed
EP-1511730-A2 DIARYL UREA DERIVATIVES USEFUL FOR THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES Novartis AG (CH) 2005-03-09 EP claimed
WO-2003099771-A2 DIARYL UREA DERIVATIVES USEFUL FOR THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES NOVARTIS AG (CH) 2003-12-04 WO claimed
US-20100280003-A1 COMBINATIONS OF JAK INHIBITORS COOKE NIGEL GRAHAM 2010-11-04 US disclosed
US-20090156602-A1 Organic Compounds COOKE NIGEL GRAHAM 2009-06-18 US disclosed
US-20080207591-A1 Organic Compounds MANLEY PAUL W 2008-08-28 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 (4 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-20100280003-A1 COMBINATIONS OF JAK INHIBITORS JAK2, JAK3, JAK1 MAPT 3528/4885RAB9A 1323/4885RAF1 30/4885
US-20080207591-A1 Organic Compounds FLT4, FLT1, FLT3 MAPT 2139/4885RAB9A 4471/4885RAF1 885/4885
US-20060128734-A1 Diaryl urea derivatives useful for the treatment of protein kinase dependent diseases UCK2, PRKDC, PRKACA MAPT 1220/4885RAB9A 1414/4885RAF1 171/4885
US-20090156602-A1 Organic Compounds BTK, JAK2, JAK3 MAPT 2307/4885RAB9A 2477/4885RAF1 52/4885

“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.