SCHEMBL8338154

SCHEMBL8338154

COc1ccc(C(=O)c2ccccc2-c2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.71
ALDH1A1 P00352 3/20 0.71
GAA P10253 2/20 0.62
POLB P06746 1/20 0.62
KMT2A Q03164 1/20 0.62
CYP2C8 P10632 1/20 0.55
CYP1A2 P05177 2/20 0.54
CYP2D6 P10635 2/20 0.54
HPGD P15428 2/20 0.54
CYP2C19 P33261 2/20 0.54
HTT P42858 2/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP11B1 P15538 1/20 0.54
CYP11B2 P19099 1/20 0.54
CES2 O00748 1/20 0.54
CES1 P23141 1/20 0.54
MAPK1 P28482 2/20 0.53
LMNA P02545 1/20 0.53
PGR P06401 1/20 0.53

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
SCHEMBL7824388 0.95 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1GAAPOLBKMT2A
SCHEMBL13356437 0.94 SMN1; SMN2 (0.62) SMN1; SMN2ALDH1A1GAAPOLBKMT2A
SCHEMBL9851196 0.90 KMT2A (0.70) SMN1; SMN2ALDH1A1KMT2ACYP1A2CYP2D6
SCHEMBL4447795 0.88 KMT2A (0.64) SMN1; SMN2ALDH1A1GAAPOLBKMT2A
SCHEMBL8333549 0.88 ALDH1A1 (0.68) SMN1; SMN2ALDH1A1GAAPOLBKMT2A
SCHEMBL29011848 0.86 GAA (0.60) SMN1; SMN2ALDH1A1GAAPOLBKMT2A
SCHEMBL30045516 0.86 GAA (0.60) SMN1; SMN2ALDH1A1GAAPOLBKMT2A
SCHEMBL10572625 0.86 ELANE (0.65) SMN1; SMN2ALDH1A1GAAPOLBKMT2A
SCHEMBL7485126 0.86 CES2 (0.67) SMN1; SMN2ALDH1A1GAAPOLBKMT2A
SCHEMBL31254507 0.85 SRD5A2 (0.59) SMN1; SMN2ALDH1A1POLBMAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7737283-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2010-06-15 US disclosed
US-7666895-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2010-02-23 US disclosed
US-7531566-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2009-05-12 US disclosed
US-20090075986-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2009-03-19 US disclosed
US-20080299639-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2008-12-04 US disclosed
US-20080187978-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2008-08-07 US disclosed
US-20080132506-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2008-06-05 US disclosed
US-20080064688-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2008-03-13 US disclosed
US-7342037-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2008-03-11 US disclosed
US-20080045706-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2008-02-21 US disclosed
US-7279576-B2 Anti-cancer medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-10-09 US disclosed
US-20070191336-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-08-16 US disclosed
US-7202257-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-04-10 US disclosed
WO-1999007694-A1 COMPOUNDS AND USES THEREOF ELI LILLY AND COMPANY (US) 1999-02-18 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-20080064688-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF SMN1; SMN2 3576/4885ALDH1A1 3257/4885GAA 2666/4885
US-20080045706-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF SMN1; SMN2 3576/4885ALDH1A1 3257/4885GAA 2666/4885
US-20090075986-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF SMN1; SMN2 3576/4885ALDH1A1 3257/4885GAA 2666/4885
US-20070191336-A1 p38 kinase inhibitors MAPK1, MAP3K8, MAP3K1 SMN1; SMN2 1101/4885ALDH1A1 3608/4885GAA 4085/4885
US-20080132506-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF SMN1; SMN2 3576/4885ALDH1A1 3257/4885GAA 2666/4885

“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.