SCHEMBL5345232

SCHEMBL5345232

CN1CCNCC1c1cccc(N)n1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 3/20 0.33
HTR2B P41595 3/20 0.33
NOS3 P29474 3/20 0.33
NOS2 P35228 3/20 0.33
HTR2A P28223 2/20 0.33
TAAR1 Q96RJ0 1/20 0.33
NOS1 P29475 2/20 0.33

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
SCHEMBL30983619 0.78 HRH3 (0.47) HTR2CHTR2BHTR2A
SCHEMBL8520212 0.77 CCR1 (0.46) HTR2CHTR2A
SCHEMBL2900748 0.76 PLD1 (0.42) HTR2CHTR2BHTR2ATAAR1
SCHEMBL6017212 0.75 KDM4E (0.47) HTR2CTAAR1
SCHEMBL12900583 0.71 DDB1 (0.39) HTR2CHTR2BHTR2ATAAR1
SCHEMBL12900585 0.71 HTR2C (0.33) HTR2CHTR2BHTR2ATAAR1
SCHEMBL3279337 0.70 CHRNB2 (0.36) TAAR1
SCHEMBL28736408 0.70 CYP1A2 (0.47)
SCHEMBL5314288 0.70 CYP2D6 (0.33)
SCHEMBL1579434 0.69 CHRNB2 (0.55) HTR2CHTR2BHTR2ATAAR1

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 HTR2C 4799/4885HTR2B 4841/4885NOS3 530/4885
US-20020173507-A1 Urea compounds and methods of uses SLC14A1, UMPS, BAX HTR2C 4757/4885HTR2B 4759/4885NOS3 235/4885
US-20040039029-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX HTR2C 4799/4885HTR2B 4841/4885NOS3 530/4885
US-20040044044-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX HTR2C 4799/4885HTR2B 4841/4885NOS3 530/4885

“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.