SCHEMBL1007128

SCHEMBL1007128

COc1cccc(C2(C#N)CC2)c1

nearest known ligand 0.78

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.78
KDM1A O60341 1/20 0.49
SLC6A4 P31645 6/20 0.43
OPRM1 P35372 3/20 0.43
SLC6A2 P23975 4/20 0.43
OPRD1 P41143 1/20 0.43
OPRK1 P41145 1/20 0.43
OPRL1 P41146 1/20 0.43
SLC6A3 Q01959 1/20 0.43
ACHE P22303 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41

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
SCHEMBL7387709 0.93 KMT2A (0.74) KMT2AKDM1ASLC6A4OPRM1SLC6A2
SCHEMBL7539835 0.93 KMT2A (0.74) KMT2AKDM1ASLC6A4OPRM1SLC6A2
SCHEMBL6313636 0.92 KMT2A (0.72) KMT2AKDM1ASLC6A4OPRM1SLC6A2
SCHEMBL23778358 0.91 KMT2A (0.70) KMT2AKDM1ASLC6A4OPRM1SLC6A2
SCHEMBL1625323 0.89 KMT2A (0.68) KMT2AKDM1ASLC6A4OPRM1SLC6A2
SCHEMBL4878379 0.89 KMT2A (0.68) KMT2AKDM1ASLC6A4OPRM1SLC6A2
SCHEMBL11860514 0.89 KMT2A (0.64) KMT2AKDM1ASLC6A4OPRM1SLC6A2
SCHEMBL11814914 0.88 KMT2A (1.00) KMT2ASLC6A4OPRM1SLC6A2SLC6A3
SCHEMBL2288239 0.88 KMT2A (0.67) KMT2AKDM1AALDH1A1
Hydrochloric Acid SCHEMBL3249332 0.88 KMT2A (0.67) KMT2AKDM1ASLC6A4OPRM1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3517109-A1 COMPOUNDS AND METHOD FOR REDUCING URIC ACID Wellstat Therapeutics Corporation (US) 2019-07-31 EP disclosed
EP-2268141-B1 COMPOUND AND METHOD FOR REDUCING URIC ACID WELLSTAT THERAPEUTICS CORP (US) 2019-05-08 EP disclosed
EP-2834238-B1 DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITORS PFIZER (US) 2017-02-01 EP disclosed
US-9296745-B2 Diacylglycerol acyltransferase 2 inhibitors PFIZER INC. (US) 2016-03-29 US disclosed
US-9115072-B2 Compounds and method for reducing uric acid WELLSTAT THERAPEUTICS CORPORATION (US) 2015-08-25 US disclosed
US-20150087585-A1 DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITORS PFIZER INC. (US) 2015-03-26 US disclosed
EP-2834238-A1 DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITORS Pfizer Inc. (US) 2015-02-11 EP disclosed
WO-2013150416-A1 DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITORS PFIZER INC. (US) 2013-10-10 WO disclosed
US-20130259850-A1 COMPOUNDS AND METHOD FOR REDUCING URIC ACID WELLSTAT THERAPEUTICS CORPORATION (US) 2013-10-03 US disclosed
EP-2268141-A1 COMPOUNDS AND METHOD FOR REDUCING URIC ACID Wellstat Therapeutics Corporation (US) 2011-01-05 EP disclosed
US-20100216788-A1 FUSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-26 US disclosed
WO-2009151695-A1 COMPOUNDS AND METHOD FOR REDUCING URIC ACID WELLSTAT THERAPEUTICS CORPORATION (US) 2009-12-17 WO disclosed
EP-1957495-A1 FUSED HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-08-20 EP disclosed
WO-2007064045-A1 FUSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-06-07 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 (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-20100216788-A1 FUSED HETEROCYCLIC COMPOUND GRK6, FGFR1, PTK6 KMT2A 186/4885KDM1A 769/4885SLC6A4 568/4885
US-20150087585-A1 DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITORS DGAT2, DGAT1, PLAAT2 KMT2A 770/4885KDM1A 2286/4885SLC6A4 1953/4885
US-20130259850-A1 COMPOUNDS AND METHOD FOR REDUCING URIC ACID RCC2, HAX1, SLC10A6 KMT2A 1121/4885KDM1A 996/4885SLC6A4 1368/4885

“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.