SCHEMBL10059697

SCHEMBL10059697

CC(C)Oc1ccc(-n2c(=O)ccc3cc(C(=O)Nc4cccc(S(=O)(=O)N(C)C)c4)[nH]c32)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.47
LMNA P02545 4/20 0.47
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
HTT P42858 1/20 0.44
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 2/20 0.43
RAB9A P51151 3/20 0.42
PKM P14618 1/20 0.42
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL10059717 0.91 TOP2A (0.40) LMNAMEN1KMT2AHTTALDH1A1
SCHEMBL10059593 0.90 CA2 (0.45) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL17612688 0.88 MEN1 (0.47) SMN1; SMN2LMNAMEN1KMT2AHTT
SCHEMBL16474863 0.85 EPHX2 (0.41) SMN1; SMN2LMNAMEN1KMT2AHTT
SCHEMBL10059698 0.85 ALDH1A1 (0.46) SMN1; SMN2LMNAMEN1KMT2AALDH1A1
SCHEMBL19942386 0.85 PLAU (0.36) SMN1; SMN2LMNAMEN1KMT2AHTT
SCHEMBL21249142 0.85 POLB (0.44) SMN1; SMN2LMNAMEN1KMT2AHTT
SCHEMBL16474873 0.85 SMN1; SMN2 (0.41) SMN1; SMN2LMNAMEN1KMT2AHTT
SCHEMBL12305112 0.84 NPC1 (0.42) SMN1; SMN2LMNAMEN1KMT2AHTT
SCHEMBL10059591 0.84 NPC1 (0.47) SMN1; SMN2KMT2AHTTALDH1A1RAB9A

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 SMN1; SMN2 3670/4885LMNA 2852/4885MEN1 4879/4885
US-20120014917-A1 METHODS OF TREATING HIV PATIENTS WITH ANTI-FIBROTICS MMP1, MMP8, CCL11 SMN1; SMN2 3479/4885LMNA 2124/4885MEN1 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.