SCHEMBL10059604

SCHEMBL10059604

CC(=O)c1cc2ccc(=O)n(-c3ccc(O)cc3)c2[nH]1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 2/20 0.37
GAA P10253 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.37
ESR2 Q92731 6/20 0.35
ESR1 P03372 6/20 0.35
TDP2 O95551 2/20 0.34
POLB P06746 1/20 0.34
HRH4 Q9H3N8 1/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
FLT3 P36888 2/20 0.33
ABL1 P00519 1/20 0.33
PDGFRB P09619 1/20 0.33
KIT P10721 1/20 0.33
BCR P11274 1/20 0.33
CYP2D6 P10635 1/20 0.32

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
SCHEMBL10059603 0.87 CYP2C9 (0.38) MAPTKDM4EMEN1GAAKMT2A
SCHEMBL13639006 0.86 ESR2 (0.35) MAPTKDM4EMEN1GAAKMT2A
SCHEMBL10079849 0.85 ALOX15 (0.43) MAPTKDM4EMEN1GAAKMT2A
SCHEMBL10079095 0.82 ALOX15 (0.46) MAPTKDM4EMEN1GAAKMT2A
SCHEMBL12333101 0.82 NPC1 (0.40) MEN1KMT2A
SCHEMBL13639026 0.79 HRH4 (0.49) HRH4
SCHEMBL10079099 0.77 SRC (0.44) MAPTMEN1KMT2AALDH1A1HTT
SCHEMBL10079693 0.77 ALDH1A1 (0.49) MEN1KMT2AALDH1A1POLB
SCHEMBL10079694 0.76 CA12 (0.52) MAPTKDM4EMEN1GAAKMT2A
SCHEMBL13575334 0.75 HSD17B10 (0.46) MAPTKDM4EMEN1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9290450-B2 Compounds and methods for treating inflammatory and fibrotic disorders INTERMUNE, INC. (US) 2016-03-22 US disclosed
US-8969347-B2 Compounds and methods for treating inflammatory and fibrotic disorders INTERMUNE, INC. 2015-03-03 US disclosed
US-20130102597-A1 COMPOUNDS AND METHODS FOR TREATING INFLAMMATORY AND FIBROTIC DISORDERS INTERMUNE, INC. (US) 2013-04-25 US disclosed
US-20120014917-A1 METHODS OF TREATING HIV PATIENTS WITH ANTI-FIBROTICS UNIVERSITY OF MINNESOTA (US) 2012-01-19 US disclosed
US-20110218515-A1 Methods for Treating Acute Myocardial Infarctions and Associated Disorders THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-09-08 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 (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-20130102597-A1 COMPOUNDS AND METHODS FOR TREATING INFLAMMATORY AND FIBROTIC DISORDERS MAP3K8, MAP3K1, MAP3K6 MAPT 3360/4885KDM4E 3381/4885MEN1 4879/4885
US-20120014917-A1 METHODS OF TREATING HIV PATIENTS WITH ANTI-FIBROTICS MMP1, MMP8, CCL11 MAPT 3357/4885KDM4E 1668/4885MEN1 4595/4885

“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.