SCHEMBL133363

SCHEMBL133363

CC(C)(C)OC(=O)N1CCCC1CO

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.58
POLB P06746 1/20 0.58
HSD17B10 Q99714 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 2/20 0.45
TSHR P16473 1/20 0.44
NPC1 O15118 1/20 0.43
PDE8B O95263 1/20 0.43
ATM Q13315 2/20 0.43
NR1H2 P55055 1/20 0.43
OPRD1 P41143 1/20 0.43
HPGD P15428 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL47049 1.00 L3MBTL1 (0.58) L3MBTL1POLBHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL135177 1.00 L3MBTL1 (0.58) L3MBTL1POLBHSD17B10SMN1; SMN2ALDH1A1
Methylene Chloride SCHEMBL28081516 0.95 POLB (0.53) L3MBTL1POLBHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL282976 0.95 POLB (0.51) L3MBTL1POLBHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL282977 0.95 POLB (0.51) L3MBTL1POLBHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL192841 0.95 POLB (0.51) L3MBTL1POLBHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL31323435 0.94 POLB (0.50) L3MBTL1POLBHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL31048468 0.94 POLB (0.50) L3MBTL1POLBHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL20399730 0.94 POLB (0.50) L3MBTL1POLBHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL3769601 0.93 HPGD (0.54) L3MBTL1POLBHSD17B10SMN1; SMN2ALDH1A1

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 1403 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111790439-B Chiral secondary amine diphenylphosphine arylformamide bifunctional catalyst and preparation method and application thereof 成都能特科技发展有限公司 2022-12-27 CN claimed
US-20090143355-A1 Substituted aryl-amine derivatives and methods of use AMGEN INC. (US) 2009-06-04 US claimed
EP-1831198-B1 PYRIDINE CARBOXAMIDE DERIVATIVES FOR USE AS ANTICANCER AGENTS ASTRAZENECA AB (SE) 2009-04-08 EP claimed
US-20080306096-A1 Quinazoline Derivatives, Process for Their Preparation and Their Use as Anti-Cancer Agents ASTRAZENECA AB (SE) 2008-12-11 US claimed
EP-1966159-A2 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2008-09-10 EP claimed
EP-1562933-B1 SUBSTITUTED AMINE DERIVATIVES AND METHODS OF USE IN THE TREATMENT OF ANGIOGENESIS RELATED DISORDERS AMGEN INC (US) 2008-03-19 EP claimed
WO-2007071963-A2 QUINAZOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTI-CANCER AGENTS ASTRAZENECA AB (SE) 2007-06-28 WO claimed
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 US claimed
US-7101868-B2 Substituted arylamine derivatives and methods of use AMGEN INC. (US) 2006-09-05 US claimed
US-7102009-B2 Substituted amine derivatives and methods of use AMGEN INC. (US) 2006-09-05 US claimed
US-20050261313-A1 Substituted alkylamine derivatives and methods of use AMGEN INC. 2005-11-24 US claimed
US-20040204437-A1 Substituted arylamine derivatives and methods of use AMGEN INC. 2004-10-14 US claimed
US-20040044044-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-03-04 US claimed
US-20040039029-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-02-26 US claimed
US-20030225106-A1 Substituted alkylamine derivatives and methods of use AMGEN INC. 2003-12-04 US claimed
US-20030203922-A1 Substituted amine derivatives and methods of use AMGEN INC. 2003-10-30 US claimed
US-20030134836-A1 Substituted arylamine derivatives and methods of use AMGEN INC. 2003-07-17 US claimed
EP-0973756-B1 THIODEPSIPEPTIDES FOR COMBATING ENDOPARASITES AND A METHOD FOR PRODUCING THE SAME BAYER AG (DE) 2003-03-26 EP claimed
US-20020193405-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2002-12-19 US claimed
US-5922117-A Ink compositions containing alcohols XEROX CORPORATION (US) 1999-07-13 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 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 L3MBTL1 854/4885POLB 2555/4885HSD17B10 2087/4885
US-20030225106-A1 Substituted alkylamine derivatives and methods of use NAT1, PIGO, AADAC L3MBTL1 1694/4885POLB 687/4885HSD17B10 1803/4885
US-20040204437-A1 Substituted arylamine derivatives and methods of use NAT1, AADAC, AHR L3MBTL1 1533/4885POLB 1312/4885HSD17B10 1351/4885
US-20080306096-A1 Quinazoline Derivatives, Process for Their Preparation and Their Use as Anti-Cancer Agents BRAF, RAF1, NRAS L3MBTL1 3866/4885POLB 1580/4885HSD17B10 4754/4885
US-20030134836-A1 Substituted arylamine derivatives and methods of use NAT1, AADAC, AHR L3MBTL1 1533/4885POLB 1312/4885HSD17B10 1351/4885
US-20030203922-A1 Substituted amine derivatives and methods of use MAOB, HNMT, FLT4 L3MBTL1 2529/4885POLB 591/4885HSD17B10 1947/4885
US-20040039029-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX L3MBTL1 854/4885POLB 2555/4885HSD17B10 2087/4885
US-20050261313-A1 Substituted alkylamine derivatives and methods of use NAT1, PIGO, AADAC L3MBTL1 1694/4885POLB 687/4885HSD17B10 1803/4885
US-20090143355-A1 Substituted aryl-amine derivatives and methods of use FLT1, FLT4, NAT1 L3MBTL1 2679/4885POLB 1694/4885HSD17B10 1546/4885
US-20040044044-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX L3MBTL1 854/4885POLB 2555/4885HSD17B10 2087/4885

“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.