SCHEMBL2881888

SCHEMBL2881888

Cc1ccc(S(=O)(=O)Nc2ccc(Oc3ccnc4c3CCN4S(=O)(=O)c3ccc(C)cc3)c(F)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.51
TP53 P04637 6/20 0.47
LMNA P02545 3/20 0.47
POLB P06746 1/20 0.45
AXL P30530 4/20 0.43
MET P08581 5/20 0.42
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 1/20 0.41
EGFR P00533 2/20 0.41
SCN9A Q15858 2/20 0.40
KIT P10721 1/20 0.39
THRB P10828 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL2881645 0.76 AXL (0.44) MAPTLMNAAXLMETALDH1A1
SCHEMBL14510799 0.69 ABL1 (0.46) MAPTPOLBALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL11030851 0.68 MST1R (0.51) MAPTLMNAAXLMETALDH1A1
SCHEMBL11032009 0.68 AXL (0.46) AXLMETALDH1A1EGFRSCN9A
SCHEMBL1160971 0.67 MST1R (0.50) LMNAAXLMETALDH1A1EGFR
SCHEMBL12873682 0.67 AXL (0.41) AXLMETEGFR
SCHEMBL1161306 0.67 AXL (0.41) AXLMETEGFRSCN9A
SCHEMBL11030763 0.67 AXL (0.43) MAPTLMNAAXLMETALDH1A1
SCHEMBL1160924 0.67 MST1R (0.49) AXLMETALDH1A1EGFRSCN9A
SCHEMBL11028415 0.67 MST1R (0.49) MAPTLMNAAXLMETALDH1A1

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-7737153-B2 Heteroaryloxy-substituted phenylaminopyrimidines as rho-kinase inhibitors BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-06-15 US disclosed
US-7737153-B2 Heteroaryloxy-substituted phenylaminopyrimidines as rho-kinase inhibitors BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-06-15 US disclosed
US-7737153-B2 Heteroaryloxy-substituted phenylaminopyrimidines as rho-kinase inhibitors BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-06-15 US disclosed
US-20060241127-A1 Heteroaryloxy-substituted phenylaminopyrimidines as rho-kinase inhibitors BAYER HEALTHCARE AG (DE) 2006-10-26 US disclosed
EP-1562935-B1 HETEROARYLOXY-SUBSTITUTED PHENYLAMINOPYRIMIDINES AS RHO-KINASE INHIBITORS BAYER HEALTHCARE AG (DE) 2006-09-06 EP disclosed
WO-2004039796-A1 HETEROARYLOXY-SUBSTITUTED PHENYLAMINOPYRIMIDINES AS RHO-KINASE INHIBITORS BAYER HEALTHCARE AG (DE) 2004-05-13 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-20060241127-A1 Heteroaryloxy-substituted phenylaminopyrimidines as rho-kinase inhibitors ROCK1, ROCK2, RHOA MAPT 2488/4885TP53 2969/4885LMNA 2876/4885

“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.