SCHEMBL307426

SCHEMBL307426

N#Cc1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.60
CA1 P00915 2/20 0.57
CA2 P00918 2/20 0.57
MMP3 P08254 1/20 0.56
BCL2L1 Q07817 1/20 0.54
BAD Q92934 1/20 0.54
SLC22A12 Q96S37 2/20 0.53
AR P10275 1/20 0.52
TP53 P04637 1/20 0.52
TSHR P16473 1/20 0.52
GSK3B P49841 2/20 0.52
MMP2 P08253 1/20 0.51
XDH P47989 1/20 0.50
RXRA P19793 2/20 0.48
RXRB P28702 2/20 0.48
EGLN2 Q96KS0 1/20 0.48

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 SCHEMBL15939679 0.98 MAP4K4 (0.59) MAP4K4CA1CA2MMP3BCL2L1
SCHEMBL216706 0.93 CA2 (0.64) MAP4K4CA1CA2SLC22A12AR
SCHEMBL28435413 0.91 CA2 (0.61) MAP4K4CA1CA2SLC22A12AR
SCHEMBL15347438 0.91 CA2 (0.61) MAP4K4CA1CA2SLC22A12AR
Hydrochloric Acid SCHEMBL3184981 0.91 CA2 (0.61) MAP4K4CA1CA2SLC22A12AR
SCHEMBL27765473 0.91 CA2 (0.61) MAP4K4CA1CA2SLC22A12AR
Ammonia Solution, Strong SCHEMBL22265084 0.91 CA2 (0.61) MAP4K4CA1CA2SLC22A12AR
SCHEMBL11453092 0.91 CA2 (0.61) MAP4K4CA1CA2SLC22A12AR
Benzoic Acid SCHEMBL9405473 0.90 TSHR (0.54) MAP4K4CA1CA2MMP3SLC22A12
SCHEMBL23037552 0.89 CA2 (0.59) MAP4K4CA1CA2BCL2L1BAD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10118919-B2 3-substituted cyclopentylamine derivatives MERCK PATENT GMBH (DE) 2018-11-06 US claimed
EP-3033339-B1 3-SUBSTITUTED CYCLOPENTYLAMINE DERIVATIVES MERCK PATENT GMBH (DE) 2018-02-28 EP claimed
US-20180022738-A1 3-SUBSTITUTED CYCLOPENTYLAMINE DERIVATIVES MERCK PATENT GMBH (DE) 2018-01-25 US claimed
US-9732032-B2 3-aminocyclopentane carboxamide derivatives MERCK PATENT GMBH (DE) 2017-08-15 US claimed
CN-104797553-B 3 aminocyclopentanecarasxamides derivatives 默克专利股份公司 2017-07-21 CN claimed
EP-2920146-B1 3-AMINOCYCLOPENTANE CARBOXAMIDE DERIVATIVES MERCK PATENT GMBH (DE) 2016-09-28 EP claimed
US-20160264517-A1 3-AMINOCYCLOPENTANE CARBOXAMIDE DERIVATIVES MERCK PATENT GMBH (DE) 2016-09-15 US claimed
US-20160200714-A1 3-SUBSTITUTED CYCLOPENTYLAMINE DERIVATIVES MERCK PATENT GMBH (DE) 2016-07-14 US claimed
EP-3033339-A1 3-SUBSTITUTED CYCLOPENTYLAMINE DERIVATIVES Merck Patent GmbH (DE) 2016-06-22 EP claimed
EP-2920146-A1 3-AMINOCYCLOPENTANE CARBOXAMIDE DERIVATIVES Merck Patent GmbH (DE) 2015-09-23 EP claimed
US-20060122432-A1 Aryl piperidine derivatives and use thereof to reduce elevated levels of ldl-cholesterol GLAXO GROUP LIMITED (GB) 2006-06-08 US claimed
EP-1534280-A1 ARYL PIPERIDINE DERIVATIVES AND USE THEREOF TO REDUCE ELEVATED LEVELS OF LDL-CHOLESTEROL GLAXO GROUP LIMITED (GB) 2005-06-01 EP claimed
US-20040147557-A1 Aryl piperidine derivatives as inducers of ldl-receptor expression BOUILLOT ANNE (FR) 2004-07-29 US claimed
US-20040077654-A1 Aryl piperidine and piperazine derivatives as inducers of ldl-receptor expression SMITHKLINE BEECHAM CORPORATION 2004-04-22 US claimed
WO-2004006923-A1 ARYL PIPERIDINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION FOR THE TREATMENT OF HYPERCHOLESTEROLEMIA GLAXO GROUP LIMITED (GB) 2004-01-22 WO claimed
WO-2004006924-A1 ARYL PIPERIDINE DERIVATIVES AND USE THEREOF TO REDUCE ELEVATED LEVELS OF LDL-CHOLESTEROL GLAXO GROUP LIMITED (GB) 2004-01-22 WO claimed
EP-1351936-A1 ARYL PIPERIDINE AND PIPERAZINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION GLAXO GROUP LIMITED (GB) 2003-10-15 EP claimed
EP-1351937-A1 ARYL PIPERIDINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION GLAXO GROUP LIMITED (GB) 2003-10-15 EP claimed
WO-2002055497-A1 ARYL PIPERIDINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION GLAXO GROUP LIMITED (GB) 2002-07-18 WO claimed
WO-2002055496-A1 ARYL PIPERIDINE AND PIPERAZINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION GLAXO GROUP LIMITED (GB) 2002-07-18 WO 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 (7 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-20160264517-A1 3-AMINOCYCLOPENTANE CARBOXAMIDE DERIVATIVES FADS1, FASN, FFAR3 MAP4K4 2216/4885CA1 1598/4885CA2 1430/4885
US-20180022738-A1 3-SUBSTITUTED CYCLOPENTYLAMINE DERIVATIVES FASN, FADS1, ACOX3 MAP4K4 2959/4885CA1 3025/4885CA2 3251/4885
US-10118919-B2 3-substituted cyclopentylamine derivatives FASN, FADS1, ACOX3 MAP4K4 2959/4885CA1 3025/4885CA2 3251/4885
US-20160200714-A1 3-SUBSTITUTED CYCLOPENTYLAMINE DERIVATIVES FASN, FADS1, ACOX3 MAP4K4 2959/4885CA1 3025/4885CA2 3251/4885
US-20060122432-A1 Aryl piperidine derivatives and use thereof to reduce elevated levels of ldl-cholesterol LDLR, NR1H2, NR1H3 MAP4K4 3202/4885CA1 4884/4885CA2 4866/4885
US-20040147557-A1 Aryl piperidine derivatives as inducers of ldl-receptor expression NR1H2, NR1H3, NR1H4 MAP4K4 3837/4885CA1 4369/4885CA2 3024/4885
US-20040077654-A1 Aryl piperidine and piperazine derivatives as inducers of ldl-receptor expression LDLR, NR1H2, NCOR1 MAP4K4 2688/4885CA1 4856/4885CA2 4604/4885

“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.