SCHEMBL10176583

SCHEMBL10176583

Cc1ccc(NC(=O)CO)c(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.59
KMT2A Q03164 5/20 0.59
ALDH1A1 P00352 3/20 0.58
HTT P42858 2/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
RAB9A P51151 3/20 0.56
KDM4E B2RXH2 4/20 0.56
NPC1 O15118 2/20 0.54
GAA P10253 2/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
ALOX12 P18054 1/20 0.51
POLB P06746 2/20 0.51
HSD17B10 Q99714 1/20 0.51
TP53 P04637 1/20 0.51
HPGD P15428 1/20 0.50
HDAC3 O15379 1/20 0.49
HDAC4 P56524 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49

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
SCHEMBL9313923 0.89 MEN1 (0.68) MEN1KMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL7264600 0.86 ALDH1A1 (0.73) MEN1KMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL31570084 0.85 MEN1 (0.57) MEN1KMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL9292088 0.85 MEN1 (0.57) MEN1KMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL13437936 0.84 KMT2A (0.82) MEN1KMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL22722429 0.83 POLB (0.59) MEN1KMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL2092509 0.82 HPGD (0.62) MEN1KMT2AALDH1A1SMN1; SMN2RAB9A
SCHEMBL23130868 0.82 CA1 (0.62) MEN1KMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL9311976 0.82 RAB9A (0.64) MEN1KMT2AALDH1A1HTTRAB9A
SCHEMBL20964640 0.82 MEN1 (0.53) MEN1KMT2AALDH1A1HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170281601-A1 NOVEL COMPOUNDS AND COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. 2017-10-05 US disclosed
US-8546437-B2 Compounds and compositions and methods of use ARDEA BIOSCIENCES, INC. (US) 2013-10-01 US disclosed
US-8357713-B2 Compounds and compositions and methods of use ARDEA BIOSCIENCES INC. (US) 2013-01-22 US disclosed
US-8283369-B2 Compounds and compositions and methods of use ARDEA BIOSCIENCES. INC. (US) 2012-10-09 US disclosed
US-20120164222-A1 NOVEL COMPOUNDS AND COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2012-06-28 US disclosed
US-8084483-B2 Compounds and compositions and methods of use ARDEA BIOSCIENCES, INC. (US) 2011-12-27 US disclosed
US-20110293719-A1 NOVEL COMPOUNDS AND COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2011-12-01 US disclosed
US-20110268801-A1 NOVEL COMPOUNDS AND COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2011-11-03 US disclosed
US-20090197825-A1 NOVEL COMPOUNDS AND COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2009-08-06 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 (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-20120164222-A1 NOVEL COMPOUNDS AND COMPOSITIONS AND METHODS OF USE XDH, PON1, GLS MEN1 3842/4885KMT2A 3006/4885ALDH1A1 186/4885
US-20090197825-A1 NOVEL COMPOUNDS AND COMPOSITIONS AND METHODS OF USE XDH, PON1, GLS MEN1 3842/4885KMT2A 3006/4885ALDH1A1 186/4885
US-20110268801-A1 NOVEL COMPOUNDS AND COMPOSITIONS AND METHODS OF USE XDH, PON1, GLS MEN1 3842/4885KMT2A 3006/4885ALDH1A1 186/4885
US-20170281601-A1 NOVEL COMPOUNDS AND COMPOSITIONS AND METHODS OF USE XDH, PON1, GLS MEN1 3842/4885KMT2A 3006/4885ALDH1A1 186/4885
US-20110293719-A1 NOVEL COMPOUNDS AND COMPOSITIONS AND METHODS OF USE XDH, PON1, GLS MEN1 3842/4885KMT2A 3006/4885ALDH1A1 186/4885

“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.