SCHEMBL5345041

SCHEMBL5345041

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

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 6/20 0.41
KDM1A O60341 5/20 0.40
PIM2 Q9P1W9 3/20 0.40
PIM3 Q86V86 2/20 0.40
FLT3 P36888 1/20 0.39
MAPK8 P45983 1/20 0.38
CNR2 P34972 1/20 0.38
PIM1 P11309 2/20 0.37
AURKA O14965 1/20 0.37
RPS6KB1 P23443 1/20 0.37
RAF1 P04049 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
SCHEMBL5348213 0.90 PIM2 (0.39) PIM2PIM3FLT3MAPK8PIM1
SCHEMBL5354502 0.90 MAPK8 (0.39) PIM2PIM3MAPK8CNR2PIM1
SCHEMBL5343142 0.89 PIM3 (0.41) EP300KDM1APIM2PIM3FLT3
SCHEMBL5348294 0.86 CDK5 (0.47) EP300KDM1APIM2PIM3FLT3
SCHEMBL5346073 0.85 CDK5 (0.54) EP300KDM1APIM2PIM3FLT3
SCHEMBL5354930 0.81 KDM4E (0.41) CNR2
SCHEMBL5348280 0.80 CDK5 (0.53) PIM2PIM3FLT3PIM1
SCHEMBL5348983 0.79 CDK5 (0.40) PIM2MAPK8PIM1
SCHEMBL14558859 0.79 CHRNB2 (0.42)
SCHEMBL5349163 0.79 BTK (0.39) PIM2FLT3MAPK8PIM1

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 EP300 3893/4885KDM1A 2930/4885PIM2 1243/4885
US-20040039029-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX EP300 3893/4885KDM1A 2930/4885PIM2 1243/4885
US-20040044044-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX EP300 3893/4885KDM1A 2930/4885PIM2 1243/4885

“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.