SCHEMBL128503

SCHEMBL128503

O=C(Nc1nc2ccccc2s1)N(CCC(c1ccccc1)c1ccccc1)CCN1CCOCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CASR P41180 20/20 1.00

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
Hydrochloric Acid SCHEMBL125409 0.99 CASR (0.98) CASR
SCHEMBL127915 0.96 CASR (0.92) CASR
SCHEMBL132764 0.93 CASR (0.87) CASR
SCHEMBL129459 0.92 CASR (0.84) CASR
SCHEMBL11990056 0.92 CASR (0.84) CASR
SCHEMBL131446 0.92 CASR (0.84) CASR
SCHEMBL125762 0.91 CASR (0.83) CASR
SCHEMBL127304 0.90 CASR (0.82) CASR
SCHEMBL126147 0.90 CASR (0.82) CASR
SCHEMBL128778 0.90 CASR (1.00) CASR

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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120283255-A1 UREA DERIVATIVES, METHODS FOR THEIR MANUFACTURE, AND USES THEREFOR GALAPAGOS SASU (FR) 2012-11-08 US claimed
US-8247412-B2 Urea derivatives methods for their manufacture and uses thereof GALAPAGOS SASU (FR) 2012-08-21 US claimed
EP-1874765-B1 UREA DERIVATIVES, METHODS FOR THEIR MANUFACTURE AND USES THEREOF GALAPAGOS SAS (FR) 2012-03-07 EP claimed
US-20110144102-A1 CALCIMIMETIC COMPOUND FOR USE IN THE TREATMENT OF EPITHELIAL INJURY AMGEN INC. 2011-06-16 US claimed
EP-2278961-A2 CALCIMIMETIC COMPOUND FOR USE IN THE TREATMENT OF EPITHELIAL INJURY Amgen, Inc (US) 2011-02-02 EP claimed
US-20100240889-A1 Urea Derivatives Methods For Their Manufacture And Uses Thereof PROSKELIA SAS (FR) 2010-09-23 US claimed
EP-2139462-A2 CALCIMIMETIC COMPOUNDS FOR USE IN THE TREATMENT OF BOWEL DISORDERS Amgen Inc. (US) 2010-01-06 EP claimed
WO-2009121015-A2 METHODS OF TREATING EPITHELIAL INJURY AMGEN INC. (US) 2009-10-01 WO claimed
EP-2037736-A1 METHODS FOR TREATING CYSTIC KIDNEY DISEASES Indiana University Research and Technology Corporation (US) 2009-03-25 EP claimed
US-20090018135-A1 Methods of treating bowel disorders AMGEN INC. (US) 2009-01-15 US claimed
EP-2010150-A2 STABLE EMULSION FORMULATIONS Amgen Inc. (US) 2009-01-07 EP claimed
WO-2008121386-A2 CALCIMIMETIC COMPOUNDS FOR USE IN THE TREATMENT OF BOWEL DISORDERS AMGEN INC. (US) 2008-10-09 WO claimed
US-20080027052-A1 METHODS FOR TREATING CYSTIC KIDNEY DISEASE INDIANA UNIVERSITY RESEARCH & TECHNOLOGY CORPORATION 2008-01-31 US claimed
WO-2008008650-A1 METHODS FOR TREATING CYSTIC KIDNEY DISEASES INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2008-01-17 WO claimed
EP-1874765-A2 UREA DERIVATIVES METHODS FOR THEIR MANUFACTURE AND USES THEREOF Proskelia SAS (FR) 2008-01-09 EP claimed
WO-2007124465-A2 STABLE EMULSION FORMULATIONS AMGEN INC. (US) 2007-11-01 WO claimed
US-20070249520-A1 STABLE EMULSION FORMULATIONS AMGEN INC. (US) 2007-10-25 US claimed
WO-2006117211-A2 UREA DERIVATIVES METHODS FOR THEIR MANUFACTURE AND USES THEREOF PROSKELIA SAS (FR) 2006-11-09 WO claimed
US-8779004-B2 Stable emulsion formulations AMGEN, INC. (US) 2014-07-15 US disclosed
WO-2006117211-A2 UREA DERIVATIVES METHODS FOR THEIR MANUFACTURE AND USES THEREOF PROSKELIA SAS (FR) 2006-11-09 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 (6 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-20090018135-A1 Methods of treating bowel disorders SLC10A2, FABP2, ALPI CASR 224/4885
US-20080027052-A1 METHODS FOR TREATING CYSTIC KIDNEY DISEASE PKD2, PKD1, REN CASR 14/4885
US-20120283255-A1 UREA DERIVATIVES, METHODS FOR THEIR MANUFACTURE, AND USES THEREFOR UTS2R, UGP2, SLC14A1 CASR 4125/4885
US-20070249520-A1 STABLE EMULSION FORMULATIONS CALCR, CALCB, CALCRL CASR 153/4885
US-20110144102-A1 CALCIMIMETIC COMPOUND FOR USE IN THE TREATMENT OF EPITHELIAL INJURY HIF1AN, HIF1A, CASR CASR 3/4885
US-20100240889-A1 Urea Derivatives Methods For Their Manufacture And Uses Thereof UGP2, UTS2R, UMPS CASR 4045/4885

“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.