SCHEMBL517633

SCHEMBL517633

C[C@@H](NC(=O)C1CCCCC1)c1ccccc1

nearest known ligand 0.91

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.91
POLB P06746 2/20 0.70
LMNA P02545 3/20 0.69
SMN1; SMN2 Q16637 2/20 0.67
ALDH1A1 P00352 1/20 0.67
USP2 O75604 1/20 0.66
ALOX15 P16050 1/20 0.66
GAA P10253 2/20 0.66
HPGD P15428 2/20 0.66
EPHX1 P07099 2/20 0.64
KCNQ3 O43525 1/20 0.63
KCNQ2 O43526 1/20 0.63
TP53 P04637 1/20 0.61
ACACB O00763 1/20 0.60

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
SCHEMBL21444578 1.00 RECQL (0.91) RECQLPOLBLMNASMN1; SMN2ALDH1A1
SCHEMBL9927461 1.00 RECQL (0.91) RECQLPOLBLMNASMN1; SMN2ALDH1A1
SCHEMBL9057935 0.98 RECQL (0.94) RECQLPOLBLMNASMN1; SMN2ALDH1A1
SCHEMBL20663584 0.95 RECQL (1.00) RECQLPOLBLMNASMN1; SMN2ALDH1A1
SCHEMBL15038847 0.95 RECQL (1.00) RECQLPOLBLMNASMN1; SMN2ALDH1A1
SCHEMBL15038846 0.92 RECQL (0.87) RECQLPOLBLMNASMN1; SMN2ALDH1A1
SCHEMBL19884283 0.92 RECQL (0.87) RECQLPOLBLMNASMN1; SMN2ALDH1A1
SCHEMBL14314483 0.92 RECQL (0.87) RECQLPOLBLMNASMN1; SMN2ALDH1A1
SCHEMBL5521105 0.86 POLB (0.73) RECQLPOLBLMNASMN1; SMN2ALDH1A1
SCHEMBL1909826 0.86 RECQL (0.77) RECQLPOLBLMNASMN1; 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9789118-B2 Bicyclic acetyl-CoA carboxylase inhibitors and uses thereof NOVARTIS AG (CH) 2017-10-17 US disclosed
US-9789118-B2 Bicyclic acetyl-CoA carboxylase inhibitors and uses thereof NOVARTIS AG (CH) 2017-10-17 US disclosed
EP-2598486-B1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS NOVARTIS AG (CH) 2017-06-28 EP disclosed
US-20140171363-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF NOVARTIS AG (CH) 2014-06-19 US disclosed
US-8697739-B2 Bicyclic acetyl-CoA carboxylase inhibitors and uses thereof NOVARTIS AG (CH) 2014-04-15 US disclosed
CN-103339111-A Bicyclic acetyl-CoA carboxylase inhibitors NOVARTIS AG 2013-10-02 CN disclosed
EP-2598486-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS Novartis AG (CH) 2013-06-05 EP disclosed
US-20120028969-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF NOVARTIS AG (CH) 2012-02-02 US disclosed
WO-2012013716-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS NOVARTIS AG (CH) 2012-02-02 WO disclosed
WO-2012013716-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS NOVARTIS AG (CH) 2012-02-02 WO disclosed
WO-2011067306-A1 CYCLOHEXANE DERIVATIVES AS INHIBITORS OF ACETYL-COA CARBOXYLASE (ACC) NOVARTIS AG (CH) 2011-06-09 WO disclosed
US-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof TAISHO PHARMACEUTICAL CO., LTD. 2005-09-08 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 (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-20140171363-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF ACACA, ACACB, COASY RECQL 2744/4885POLB 1792/4885LMNA 2697/4885
US-20120028969-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF ACACA, ACACB, COASY RECQL 2744/4885POLB 1792/4885LMNA 2697/4885
US-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof HCRTR2, MCHR1, MCHR2 RECQL 385/4885POLB 3369/4885LMNA 3391/4885

“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.