SCHEMBL16294253

SCHEMBL16294253

COc1ccc(-c2c(C#N)c(SC(C(=O)O)c3ccccc3)nc3c2CCCC3)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.64
ALDH1A1 P00352 11/20 0.63
KDM4E B2RXH2 6/20 0.63
GAA P10253 1/20 0.53
MAPT P10636 4/20 0.52
KMT2A Q03164 6/20 0.52
MEN1 O00255 5/20 0.52
HPGD P15428 4/20 0.50
FNTA P49354 1/20 0.50
FNTB P49356 1/20 0.50
HSD17B10 Q99714 4/20 0.48
MAPK1 P28482 2/20 0.48
ALOX15 P16050 2/20 0.48
ALOX12 P18054 1/20 0.48
RET P07949 2/20 0.46
ALK Q9UM73 1/20 0.46
NPSR1 Q6W5P4 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL16294567 0.93 ALDH1A1 (0.61) RXFP1ALDH1A1KDM4EGAAMAPT
SCHEMBL16295295 0.91 RXFP1 (0.69) RXFP1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL16295301 0.88 RXFP1 (0.64) RXFP1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL16295353 0.86 NPSR1 (0.60) RXFP1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL16295277 0.84 NPSR1 (0.55) RXFP1ALDH1A1KDM4EGAAMAPT
SCHEMBL13913768 0.82 ADORA1 (0.58) RXFP1ALDH1A1KDM4EGAAMAPT
SCHEMBL17738785 0.81 RXFP1 (0.67) RXFP1ALDH1A1KDM4EGAAMAPT
SCHEMBL16303976 0.81 RXFP1 (0.57) RXFP1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL16294693 0.80 RXFP1 (0.91) RXFP1ALDH1A1KDM4EGAAMAPT
SCHEMBL16303979 0.79 RXFP1 (0.53) RXFP1ALDH1A1KDM4EMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10548313-B2 Acetyl-CoA carboxylase modulators MONSANTO TECHNOLOGY LLC (US) 2020-02-04 US claimed
US-20180070589-A1 ACETYL-COA CARBOXYLASE MODULATORS MONSANTO TECHNOLOGY LLC (US) 2018-03-15 US claimed
US-20160130229-A1 ACETYL-COA CARBOXYLASE MODULATORS MONSANTO TECHNOLOGY LLC (US) 2016-05-12 US claimed
WO-2014201326-A1 ACETYL-COA CARBOXYLASE MODULATORS MONSANTO TECHNOLOGY LLC (US) 2014-12-18 WO claimed
US-11375716-B2 Acetyl-CoA carboxylase modulators MONSANTO TECHNOLOGY LLC (US) 2022-07-05 US disclosed
US-11375716-B2 Acetyl-CoA carboxylase modulators MONSANTO TECHNOLOGY LLC (US) 2022-07-05 US disclosed
US-20200214289-A1 ACETYL-COA CARBOXYLASE MODULATORS MONSANTO TECHNOLOGY LLC (US) 2020-07-09 US disclosed
US-20200214289-A1 ACETYL-COA CARBOXYLASE MODULATORS MONSANTO TECHNOLOGY LLC (US) 2020-07-09 US disclosed
US-10548313-B2 Acetyl-CoA carboxylase modulators MONSANTO TECHNOLOGY LLC (US) 2020-02-04 US disclosed
US-10548313-B2 Acetyl-CoA carboxylase modulators MONSANTO TECHNOLOGY LLC (US) 2020-02-04 US disclosed
US-20180070589-A1 ACETYL-COA CARBOXYLASE MODULATORS MONSANTO TECHNOLOGY LLC (US) 2018-03-15 US disclosed
US-20180070589-A1 ACETYL-COA CARBOXYLASE MODULATORS MONSANTO TECHNOLOGY LLC (US) 2018-03-15 US disclosed
US-20180070589-A1 ACETYL-COA CARBOXYLASE MODULATORS MONSANTO TECHNOLOGY LLC (US) 2018-03-15 US disclosed
US-9844218-B2 Acetyl-CoA carboxylase modulators MONSANTO TECHNOLOGY LLC (US) 2017-12-19 US disclosed
US-9844218-B2 Acetyl-CoA carboxylase modulators MONSANTO TECHNOLOGY LLC (US) 2017-12-19 US disclosed
US-9844218-B2 Acetyl-CoA carboxylase modulators MONSANTO TECHNOLOGY LLC (US) 2017-12-19 US disclosed
US-20160130229-A1 ACETYL-COA CARBOXYLASE MODULATORS MONSANTO TECHNOLOGY LLC (US) 2016-05-12 US disclosed
US-20160130229-A1 ACETYL-COA CARBOXYLASE MODULATORS MONSANTO TECHNOLOGY LLC (US) 2016-05-12 US disclosed
US-20160130229-A1 ACETYL-COA CARBOXYLASE MODULATORS MONSANTO TECHNOLOGY LLC (US) 2016-05-12 US disclosed
WO-2014201326-A1 ACETYL-COA CARBOXYLASE MODULATORS MONSANTO TECHNOLOGY LLC (US) 2014-12-18 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 (5 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-20160130229-A1 ACETYL-COA CARBOXYLASE MODULATORS ACACA, ACACB, ACAT2 RXFP1 4585/4885ALDH1A1 1039/4885KDM4E 1598/4885
US-11375716-B2 Acetyl-CoA carboxylase modulators ACACA, ACACB, ACAT2 RXFP1 4585/4885ALDH1A1 1039/4885KDM4E 1598/4885
US-10548313-B2 Acetyl-CoA carboxylase modulators ACACA, ACACB, ACAT2 RXFP1 4585/4885ALDH1A1 1039/4885KDM4E 1598/4885
US-20200214289-A1 ACETYL-COA CARBOXYLASE MODULATORS ACACA, ACACB, ACAT2 RXFP1 4585/4885ALDH1A1 1039/4885KDM4E 1598/4885
US-20180070589-A1 ACETYL-COA CARBOXYLASE MODULATORS ACACA, ACACB, ACAT2 RXFP1 4585/4885ALDH1A1 1039/4885KDM4E 1598/4885

“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.