SCHEMBL8945322

SCHEMBL8945322

CCN(CC)C(=O)Oc1ccc(C)cc1

nearest known ligand 0.85

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.85
MEN1 O00255 2/20 0.85
HSD17B10 Q99714 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
LMNA P02545 4/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
MAOA P21397 4/20 0.53
SRD5A1 P18405 1/20 0.51
ALDH1A1 P00352 2/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
RAB9A P51151 1/20 0.50
GAA P10253 1/20 0.49
TRPM8 Q7Z2W7 1/20 0.48
MAOB P27338 2/20 0.46
MAPT P10636 1/20 0.45
MAPK1 P28482 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL9302685 0.92 MEN1 (1.00) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL5623889 0.86 MEN1 (0.88) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL16724735 0.83 MEN1 (0.58) KMT2AMEN1SMN1; SMN2LMNAMAOA
SCHEMBL19439086 0.83 MEN1 (0.81) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL8945706 0.83 MEN1 (0.81) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL12928357 0.83 MEN1 (0.81) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL10013782 0.83 MEN1 (0.81) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL11065585 0.83 KMT2A (0.58) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL2531879 0.83 MEN1 (0.81) KMT2AMEN1HSD17B10SMN1; SMN2LMNA
SCHEMBL5623546 0.82 MEN1 (0.81) KMT2AMEN1HSD17B10SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9567307-B2 Amination of aryl alcohol derivatives THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-02-14 US disclosed
US-9567307-B2 Amination of aryl alcohol derivatives THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-02-14 US disclosed
EP-2997049-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2016-03-23 EP disclosed
WO-2014184289-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2014-11-20 WO disclosed
US-20130289270-A1 Amination of Aryl Alcohol Derivatives THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-10-31 US disclosed
US-20130289270-A1 Amination of Aryl Alcohol Derivatives THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-10-31 US disclosed
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-12-02 US disclosed
US-5510375-A VIRICIDES TREATING INFECTION CAUSED BY HUMAN IMMUNODEFICIENCY VIRUS AND AIDS WARNER-LAMBERT COMPANY (US) 1996-04-23 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-20100305100-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS KMT2A 4464/4885MEN1 4800/4885HSD17B10 1276/4885
US-20130289270-A1 Amination of Aryl Alcohol Derivatives SULT2A1, SULT1A1, ADH5 KMT2A 122/4885MEN1 4461/4885HSD17B10 1183/4885

“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.