SCHEMBL869233

SCHEMBL869233

O=C(Cl)c1sc2cc(C(F)(F)F)ccc2c1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCKDK O14874 2/20 0.50
MCL1 Q07820 3/20 0.49
RXFP1 Q9HBX9 2/20 0.49
BCL2L1 Q07817 1/20 0.47
MGLL Q99685 1/20 0.46
F10 P00742 1/20 0.45
TASP1 Q9H6P5 1/20 0.44
TSHR P16473 2/20 0.43
PRNP P04156 1/20 0.43
MAPK1 P28482 1/20 0.43
PPARG P37231 1/20 0.43
HTT P42858 1/20 0.43
MAPK10 P53779 1/20 0.43
NCOA2 Q15596 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
RAB9A P51151 5/20 0.42
NPC1 O15118 4/20 0.41
MAPT P10636 3/20 0.41
LMNA P02545 2/20 0.41
GAA P10253 2/20 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
SCHEMBL31194453 1.00 BCKDK (0.50) BCKDKMCL1RXFP1BCL2L1MGLL
SCHEMBL868993 0.88 BCKDK (0.66) BCKDKMCL1RXFP1BCL2L1MGLL
SCHEMBL120426 0.85 ESR1 (0.43) BCKDKMCL1RXFP1MGLLF10
SCHEMBL6840329 0.84 MEN1 (0.40) BCKDKMCL1BCL2L1MGLLRAB9A
SCHEMBL692750 0.80 CSNK1D (0.41) RXFP1TSHRPRNPMAPK1PPARG
SCHEMBL28836579 0.80 LMNA (0.48) BCKDKMCL1RXFP1BCL2L1TSHR
SCHEMBL30099150 0.80 LMNA (0.48) BCKDKMCL1RXFP1BCL2L1TSHR
SCHEMBL2279755 0.80 BCKDK (0.77) BCKDKMCL1RXFP1BCL2L1TSHR
SCHEMBL2723054 0.79 BCKDK (0.75) BCKDKMCL1RXFP1BCL2L1TSHR
SCHEMBL5023231 0.76 MCL1 (0.77) BCKDKMCL1RXFP1BCL2L1F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115023426-A Pesticidally active heterocyclic derivatives with sulfur-containing substituents 先正达农作物保护股份公司 2022-09-06 CN disclosed
US-9409880-B2 Modulators of TLR3/dsRNA complex and uses thereof THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2016-08-09 US disclosed
US-9409880-B2 Modulators of TLR3/dsRNA complex and uses thereof THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2016-08-09 US disclosed
US-9375430-B2 Monoacylglycerol lipase inhibitors for the treatment of metabolic diseases and related disorders JANSSEN PHARMACEUTICA NV (BE) 2016-06-28 US disclosed
US-9375430-B2 Monoacylglycerol lipase inhibitors for the treatment of metabolic diseases and related disorders JANSSEN PHARMACEUTICA NV (BE) 2016-06-28 US disclosed
EP-2760451-A1 MONOACYLGLYCEROL LIPASE INHIBITORS FOR THE TREATMENT OF METABOLIC DISEASES AND RELATED DISORDERS Janssen Pharmaceutica N.V. (BE) 2014-08-06 EP disclosed
US-8637498-B2 Oxopiperazine-azetidine amides and oxodiazepine-azetidine amides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2014-01-28 US disclosed
US-8637498-B2 Oxopiperazine-azetidine amides and oxodiazepine-azetidine amides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2014-01-28 US disclosed
EP-2621918-A1 OXOPIPERAZINE-AZETIDINE AMIDES AND OXODIAZEPINE-AZETIDINE AMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica, N.V. (BE) 2013-08-07 EP disclosed
US-20130085130-A1 MONOACYLGLYCEROL LIPASE INHIBITORS FOR THE TREATMENT OF METABOLIC DISEASES AND RELATED DISORDERS JANSSEN PHARMACEUTICA NV (US) 2013-04-04 US disclosed
US-20130085130-A1 MONOACYLGLYCEROL LIPASE INHIBITORS FOR THE TREATMENT OF METABOLIC DISEASES AND RELATED DISORDERS JANSSEN PHARMACEUTICA NV (US) 2013-04-04 US disclosed
WO-2013049293-A1 MONOACYLGLYCEROL LIPASE INHIBITORS FOR THE TREATMENT OF METABOLIC DISEASES AND RELATED DISORDERS JANSSEN PHARMACEUTICA NV (BE) 2013-04-04 WO disclosed
WO-2013049293-A1 MONOACYLGLYCEROL LIPASE INHIBITORS FOR THE TREATMENT OF METABOLIC DISEASES AND RELATED DISORDERS JANSSEN PHARMACEUTICA NV (BE) 2013-04-04 WO disclosed
WO-2012099785-A2 MODULATORS OF TLR3/DSRNA COMPLEX AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2012-07-26 WO disclosed
WO-2012044613-A1 OXOPIPERAZINE-AZETIDINE AMIDES AND OXODIAZEPINE-AZETIDINE AMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2012-04-05 WO disclosed
WO-2012044613-A1 OXOPIPERAZINE-AZETIDINE AMIDES AND OXODIAZEPINE-AZETIDINE AMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2012-04-05 WO disclosed
US-20120077797-A1 OXOPIPERAZINE-AZETIDINE AMIDES AND OXODIAZEPINE-AZETIDINE AMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2012-03-29 US disclosed
US-20120077797-A1 OXOPIPERAZINE-AZETIDINE AMIDES AND OXODIAZEPINE-AZETIDINE AMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2012-03-29 US 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 (2 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-20120077797-A1 OXOPIPERAZINE-AZETIDINE AMIDES AND OXODIAZEPINE-AZETIDINE AMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS LPL, PNLIP, LIPA BCKDK 791/4885MCL1 3086/4885RXFP1 2280/4885
US-20130085130-A1 MONOACYLGLYCEROL LIPASE INHIBITORS FOR THE TREATMENT OF METABOLIC DISEASES AND RELATED DISORDERS PNLIP, LIPC, LPL BCKDK 392/4885MCL1 3827/4885RXFP1 3133/4885

“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.