SCHEMBL5348279

SCHEMBL5348279

CCCCOC(=O)Nc1cccc(CC#N)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.46
HPGD P15428 4/20 0.46
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 7/20 0.46
NPC1 O15118 7/20 0.46
CYP1A2 P05177 3/20 0.46
CYP2C19 P33261 3/20 0.46
ALDH1A1 P00352 2/20 0.46
NFKB1 P19838 1/20 0.46
STAT1 P42224 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
CHRNB2 P17787 1/20 0.45
CHRNB4 P30926 1/20 0.45
CHRNA3 P32297 1/20 0.45
CHRNA4 P43681 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
CYP2C9 P11712 1/20 0.44
MAPT P10636 2/20 0.43
HSD17B10 Q99714 2/20 0.43

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
SCHEMBL7057484 0.86 CHRNB2 (0.58) RAB9AHPGDLMNASMN1; SMN2NPC1
SCHEMBL14879934 0.85 RAB9A (0.50) RAB9AHPGDLMNASMN1; SMN2NPC1
SCHEMBL30395909 0.85 RAB9A (0.50) RAB9AHPGDLMNASMN1; SMN2NPC1
SCHEMBL5352818 0.84 RAB9A (0.49) RAB9AHPGDLMNASMN1; SMN2NPC1
SCHEMBL10084279 0.82 CHRNB2 (0.54) RAB9AHPGDLMNASMN1; SMN2NPC1
SCHEMBL5347879 0.81 RAB9A (0.50) RAB9AHPGDLMNASMN1; SMN2NPC1
SCHEMBL5347545 0.79 RAB9A (0.64) RAB9AHPGDLMNASMN1; SMN2NPC1
SCHEMBL14558305 0.79 CTSS (0.41) SMN1; SMN2
SCHEMBL3632906 0.78 RAB9A (0.51) RAB9AHPGDLMNASMN1; SMN2NPC1
SCHEMBL10082517 0.78 CHRNB2 (0.61) RAB9AHPGDSMN1; SMN2NPC1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 US disclosed
EP-1309589-B1 UREA COMPOUNDS AND METHODS OF USES AMGEN INC (US) 2006-03-15 EP disclosed
EP-1619184-A2 Urea compounds as kinase inhibitors Amgen, Inc. (US) 2006-01-25 EP 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
EP-1309589-A2 UREA COMPOUNDS AND METHODS OF USES Amgen Inc. (US) 2003-05-14 EP disclosed
US-20020193405-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2002-12-19 US disclosed
US-20020173507-A1 Urea compounds and methods of uses AMGEN INC. 2002-11-21 US disclosed
WO-2002014311-A2 UREA COMPOUNDS AND METHODS OF USES AMGEN INC. (US) 2002-02-21 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 (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-20020193405-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX RAB9A 3370/4885HPGD 672/4885LMNA 2067/4885
US-20020173507-A1 Urea compounds and methods of uses SLC14A1, UMPS, BAX RAB9A 2958/4885HPGD 329/4885LMNA 1241/4885
US-20040039029-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX RAB9A 3370/4885HPGD 672/4885LMNA 2067/4885
US-20040044044-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX RAB9A 3370/4885HPGD 672/4885LMNA 2067/4885

“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.