SCHEMBL1948433

SCHEMBL1948433

CC(C)Oc1ccc(NC(=O)CCl)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.64
MAPT P10636 7/20 0.64
KMT2A Q03164 5/20 0.64
NLRP1 Q9C000 1/20 0.64
GLA P06280 1/20 0.63
RNF4 P78317 1/20 0.59
LMNA P02545 6/20 0.55
TP53 P04637 3/20 0.55
MEN1 O00255 2/20 0.55
GAA P10253 2/20 0.55
MAPK1 P28482 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.53
NPC1 O15118 4/20 0.53
RAB9A P51151 4/20 0.53
MITF O75030 2/20 0.53
XBP1 P17861 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
NOD2 Q9HC29 1/20 0.53
HTT P42858 3/20 0.52
HSD17B10 Q99714 2/20 0.52

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
SCHEMBL13652528 0.85 ALDH1A1 (0.66) ALDH1A1MAPTKMT2ANLRP1GLA
SCHEMBL20679552 0.83 RNF4 (0.59) ALDH1A1MAPTKMT2ARNF4MEN1
SCHEMBL29678387 0.83 ALDH1A1 (0.67) ALDH1A1RNF4MAPK1SMN1; SMN2NPC1
SCHEMBL10654061 0.83 ALDH1A1 (0.67) ALDH1A1RNF4MAPK1SMN1; SMN2NPC1
SCHEMBL1289638 0.81 L3MBTL1 (0.69) ALDH1A1MAPTKMT2ARNF4LMNA
SCHEMBL11806908 0.80 RNF4 (0.86) ALDH1A1MAPTKMT2AGLARNF4
SCHEMBL9081388 0.80 NPC1 (0.76) ALDH1A1MAPTKMT2ARNF4LMNA
SCHEMBL29324281 0.80 ALDH1A1 (0.72) ALDH1A1MAPTKMT2ANLRP1GLA
SCHEMBL2091569 0.79 GLA (0.71) ALDH1A1MAPTKMT2ANLRP1GLA
SCHEMBL2091571 0.79 GLA (0.71) ALDH1A1MAPTKMT2ANLRP1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2373634-B1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARM CO LTD (JP) 2015-11-11 EP disclosed
US-8987242-B2 Morpholinone compounds as factor IXA inhibitors MERCK SHARP & DOHME CORP. (US) 2015-03-24 US disclosed
US-8642582-B2 Morpholinone compounds as factor IXa inhibitors MERCK SHARP & DOHME CORP. (US) 2014-02-04 US disclosed
EP-2373634-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS Mochida Pharmaceutical Co., Ltd. (JP) 2011-10-12 EP disclosed
US-20110135650-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-06-09 US disclosed
US-20110059958-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-03-10 US disclosed
WO-2010065717-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-06-10 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 (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-20110135650-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS SERPINC1, F9, F8 ALDH1A1 2444/4885MAPT 3534/4885KMT2A 1610/4885
US-20110059958-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS SERPINC1, F9, F8 ALDH1A1 2444/4885MAPT 3534/4885KMT2A 1610/4885

“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.