SCHEMBL1255148

SCHEMBL1255148

O=C(Cl)c1sc2ccc(F)cc2c1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCKDK O14874 2/20 0.58
▸ RAB9A P51151 3/20 0.48
▸ KDM4E B2RXH2 1/20 0.47
▸ SENP1 Q9P0U3 1/20 0.45
▸ MCL1 Q07820 3/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ TSHR P16473 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ BCL2L1 Q07817 1/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ MAOB P27338 1/20 0.43
▸ CASP3 P42574 1/20 0.43
▸ GPER1 Q99527 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ RECQL P46063 1/20 0.42
▸ F10 P00742 2/20 0.42
▸ MAPT P10636 1/20 0.41
▸ HPGD P15428 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
SCHEMBL14293108 0.87 BCKDK (0.58) BCKDKRAB9AKDM4ESENP1MCL1
SCHEMBL2279755 0.87 BCKDK (0.77) BCKDKRAB9AKDM4ESENP1MCL1
SCHEMBL8877598 0.83 MCL1 (0.56) BCKDKRAB9AKDM4EMCL1SMN1; SMN2
SCHEMBL13659612 0.83 BCKDK (0.54) BCKDKRAB9AKDM4ESENP1MCL1
SCHEMBL1254412 0.80 MCL1 (0.51) BCKDKRAB9AKDM4EMCL1SMN1; SMN2
SCHEMBL3063440 0.79 BCKDK (0.49) BCKDKRAB9AKDM4ESENP1MCL1
SCHEMBL1447569 0.79 PRNP (0.60) RAB9AKDM4ESMN1; SMN2NPC1TSHR
SCHEMBL3067147 0.78 MCL1 (0.41) BCKDKRAB9AMCL1SMN1; SMN2NPC1
SCHEMBL12581557 0.78 MCL1 (0.41) BCKDKRAB9AKDM4EMCL1SMN1; SMN2
SCHEMBL12553241 0.78 MCL1 (0.41) BCKDKRAB9AKDM4EMCL1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
EP-2848614-A2 Acrylamide derivatives as antibiotic agents Debiopharm International SA (CH) 2015-03-18 — — EP disclosed
US-20140107106-A1 THERAPEUTIC AGENTS, AND METHODS OF MAKING AND USING THE SAME AFFINIUM PHARMACEUTICALS, INC. (CA) 2014-04-17 — — US disclosed
US-20140107106-A1 THERAPEUTIC AGENTS, AND METHODS OF MAKING AND USING THE SAME AFFINIUM PHARMACEUTICALS, INC. (CA) 2014-04-17 — — US disclosed
US-20140107106-A1 THERAPEUTIC AGENTS, AND METHODS OF MAKING AND USING THE SAME AFFINIUM PHARMACEUTICALS, INC. (CA) 2014-04-17 — — US disclosed
EP-2665708-A2 MODULATORS OF TLR3/DSRNA COMPLEX AND USES THEREOF The Regents of the University of Colorado, A Body Corporate (US) 2013-11-27 — — EP disclosed
US-8450307-B2 Therapeutic agents, and methods of making and using the same AFFINIUM PHARMACEUTICALS, INC. (CA) 2013-05-28 — — US 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-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
US-20120010127-A1 Compositions Comprising Multiple Bioactive Agents, and Methods of Using the Same BERMAN JUDD M (CA) 2012-01-12 — — US disclosed
US-7879872-B2 comprising (E)-N-methyl-N-(3-methylbenzofuran-2-ylmethyl)-3-(7-oxo-5,6,7,8-tetrahydro-1,8-naphthyridin-3-yl)acrylamide or pharmaceutically acceptable salts thereof; and gentamicin; wherein combination has an fractional inhibitory coconcentration index value of 0.3 against S. aureus 29213 AFFINIUM PHARMACEUTICALS, INC. (CA) 2011-02-01 — — US disclosed
US-20100093705-A1 Therapeutic agents, and methods of making and using the same DEBIOPHARM INTERNATIONAL SA (CH) 2010-04-15 — — US disclosed
US-20100093705-A1 Therapeutic agents, and methods of making and using the same DEBIOPHARM INTERNATIONAL SA (CH) 2010-04-15 — — US disclosed
US-20100093705-A1 Therapeutic agents, and methods of making and using the same DEBIOPHARM INTERNATIONAL SA (CH) 2010-04-15 — — US disclosed
US-20060142265-A1 Compositions comprising multiple bioactive agents, and methods of using the same AFFINIUM PHARMACEUTICALS, INC. (CA) 2006-06-29 — — 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 (4 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-20100093705-A1 Therapeutic agents, and methods of making and using the same MCL1, DHFR, ANXA5 BCKDK 1986/4885RAB9A 2777/4885KDM4E 4494/4885
US-20120010127-A1 Compositions Comprising Multiple Bioactive Agents, and Methods of Using the Same DBI, SERPINB1, CTSF BCKDK 2182/4885RAB9A 2755/4885KDM4E 4139/4885
US-20140107106-A1 THERAPEUTIC AGENTS, AND METHODS OF MAKING AND USING THE SAME MCL1, DHFR, ANXA5 BCKDK 1986/4885RAB9A 2777/4885KDM4E 4494/4885
US-20060142265-A1 Compositions comprising multiple bioactive agents, and methods of using the same DBI, SERPINB1, CTSF BCKDK 2182/4885RAB9A 2755/4885KDM4E 4139/4885

“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.

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