SCHEMBL516693

SCHEMBL516693

O=S(=O)(Cl)c1ccc2nc(-c3ccccc3)oc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
ALDH1A1 P00352 2/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
LMNA P02545 3/20 0.52
TP53 P04637 3/20 0.52
CASP3 P42574 3/20 0.51
SENP7 Q9BQF6 3/20 0.51
SENP6 Q9GZR1 3/20 0.51
SENP8 Q96LD8 2/20 0.51
PTPN1 P18031 9/20 0.51
PTPN5 P54829 9/20 0.51
PTPN2 P17706 8/20 0.51
HPGD P15428 3/20 0.50
KDM4E B2RXH2 2/20 0.50
CYP1A2 P05177 1/20 0.50

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
SCHEMBL19465806 0.85 MAPT (0.58) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL8120431 0.83 PTPN1 (0.64) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL10934551 0.82 HDAC6 (0.57) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL24295224 0.77 GPR119 (0.62) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL15895561 0.77 PTPN1 (0.57) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL15895562 0.77 ESR1 (0.57) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL27652467 0.77 MAPT (0.58) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL2242624 0.76 SMN1; SMN2 (0.76) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL28759272 0.76 MAPT (0.64) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL29820037 0.76 GPR119 (0.61) MAPTSMN1; SMN2MEN1KMT2ANPC1

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 11 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
US-9789118-B2 Bicyclic acetyl-CoA carboxylase inhibitors and uses thereof NOVARTIS AG (CH) 2017-10-17 US disclosed
US-20140171363-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF NOVARTIS AG (CH) 2014-06-19 US disclosed
US-20140171363-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF NOVARTIS AG (CH) 2014-06-19 US 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
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
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

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-20140171363-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF ACACA, ACACB, COASY MAPT 1271/4885SMN1; SMN2 4695/4885MEN1 3950/4885
US-20120028969-A1 BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF ACACA, ACACB, COASY MAPT 1271/4885SMN1; SMN2 4695/4885MEN1 3950/4885

“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.