SCHEMBL5343142

SCHEMBL5343142

O=C(Nc1cccc(OCC2CCNCC2)n1)Nc1csc(Cl)n1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 1/20 0.41
PIM2 Q9P1W9 1/20 0.41
FLT3 P36888 1/20 0.40
CDK5 Q00535 3/20 0.39
CDK5R1 Q15078 3/20 0.39
CCNA2 P20248 2/20 0.39
CDK2 P24941 2/20 0.39
CCNA1 P78396 2/20 0.39
KDM1A O60341 1/20 0.38
CHRM1 P11229 2/20 0.38
CNR2 P34972 1/20 0.37
MAPK8 P45983 1/20 0.37
P2RY1 P47900 4/20 0.37
EP300 Q09472 1/20 0.37
RAF1 P04049 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM3 P20309 1/20 0.36

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
SCHEMBL5348983 0.90 CDK5 (0.40) PIM2CDK5CDK5R1CCNA2CDK2
SCHEMBL5347500 0.90 PIM1 (0.40) PIM3PIM2CDK5CDK5R1CCNA2
SCHEMBL5345041 0.89 EP300 (0.41) PIM3PIM2FLT3KDM1ACNR2
SCHEMBL5348294 0.85 CDK5 (0.47) PIM3PIM2FLT3CDK5CDK5R1
SCHEMBL5346073 0.85 CDK5 (0.54) PIM3PIM2FLT3CDK5CDK5R1
SCHEMBL5346218 0.81 KDM4E (0.43) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL5348280 0.79 CDK5 (0.53) PIM3PIM2FLT3CDK5CDK5R1
SCHEMBL5348213 0.79 PIM2 (0.39) PIM3PIM2FLT3CDK5CDK5R1
SCHEMBL5353312 0.79 CHRNB2 (0.43) CDK5CDK5R1CCNA2CDK2CCNA1
SCHEMBL14558861 0.79 CHRNB2 (0.43) CDK5CDK5R1CCNA2CDK2CCNA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1483263-A1 THIAZOLYL UREA COMPOUNDS FOR THE TREATMENT OF CANCER Amgen Inc. (US) 2004-12-08 EP claimed
US-20040044044-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-03-04 US claimed
US-20040039029-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-02-26 US claimed
US-6645990-B2 For prophylaxis and therapy of diseases, such as cell proliferation or apoptosis mediated diseases AMGEN INC. 2003-11-11 US claimed
WO-2003070727-A1 THIAZOLYL UREA COMPOUNDS FOR THE TREATMENT OF CANCER AMGEN INC. (US) 2003-08-28 WO claimed
US-20020193405-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2002-12-19 US claimed
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 US disclosed
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 US disclosed
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 US disclosed
EP-1483263-A1 THIAZOLYL UREA COMPOUNDS FOR THE TREATMENT OF CANCER Amgen Inc. (US) 2004-12-08 EP disclosed
US-20040044044-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-03-04 US disclosed
US-20040039029-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-02-26 US disclosed
US-6645990-B2 For prophylaxis and therapy of diseases, such as cell proliferation or apoptosis mediated diseases AMGEN INC. 2003-11-11 US disclosed
WO-2003070727-A1 THIAZOLYL UREA COMPOUNDS FOR THE TREATMENT OF CANCER AMGEN INC. (US) 2003-08-28 WO disclosed
US-20020193405-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2002-12-19 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 (3 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-20020193405-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX PIM3 931/4885PIM2 1243/4885FLT3 782/4885
US-20040039029-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX PIM3 931/4885PIM2 1243/4885FLT3 782/4885
US-20040044044-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX PIM3 931/4885PIM2 1243/4885FLT3 782/4885

“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.