SCHEMBL5346199

SCHEMBL5346199

OC1CCN(Cc2cccc(Br)n2)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.52
CXCR4 P61073 2/20 0.46
ACHE P22303 1/20 0.46
DRD2 P14416 1/20 0.41
DRD3 P35462 1/20 0.41
MAPT P10636 1/20 0.40
RAB9A P51151 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 1/20 0.40
KCNA3 P22001 1/20 0.39
LTA4H P09960 1/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP2D6 P10635 1/20 0.38
CNR1 P21554 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
SCHEMBL5345098 0.84 ACHE (0.50) FAAHCXCR4ACHEDRD2DRD3
SCHEMBL5345901 0.82 ALDH1A1 (0.55) FAAHCXCR4MAPTL3MBTL1LTA4H
SCHEMBL5343494 0.81 CXCR4 (0.46) CXCR4MAPTRAB9AL3MBTL1NPC1
SCHEMBL5346879 0.81 L3MBTL3 (0.57) FAAHCXCR4ACHEDRD2DRD3
SCHEMBL13374356 0.81 FAAH (0.46) FAAHCXCR4ACHEDRD2DRD3
SCHEMBL839038 0.80 FAAH (0.53) FAAHCXCR4ACHEDRD2DRD3
SCHEMBL5253618 0.78 FAAH (0.54) FAAHCXCR4ACHEDRD2DRD3
SCHEMBL29462386 0.78 FAAH (0.54) FAAHCXCR4ACHEDRD2DRD3
SCHEMBL5255062 0.78 FAAH (0.54) FAAHCXCR4ACHEDRD2DRD3
SCHEMBL465778 0.78 CXCR4 (0.77) FAAHCXCR4KMT2AKDM4EHTT

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 FAAH 3791/4885CXCR4 2256/4885ACHE 1578/4885
US-20020173507-A1 Urea compounds and methods of uses SLC14A1, UMPS, BAX FAAH 2650/4885CXCR4 2255/4885ACHE 902/4885
US-20040039029-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX FAAH 3791/4885CXCR4 2256/4885ACHE 1578/4885
US-20040044044-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX FAAH 3791/4885CXCR4 2256/4885ACHE 1578/4885

“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.