SCHEMBL609111

SCHEMBL609111

COc1ccc(C(NC(=O)CCc2ccccc2)c2cc(Cl)c3cccnc3c2O)cc1OC

nearest known ligand 0.82

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.82
NPC1 O15118 5/20 0.82
SMN1; SMN2 Q16637 4/20 0.82
LMNA P02545 3/20 0.82
TDP1 Q9NUW8 3/20 0.82
HSP90AA1 P07900 3/20 0.82
KDM4E B2RXH2 2/20 0.82
MITF O75030 1/20 0.82
KMT2A Q03164 6/20 0.78
MEN1 O00255 4/20 0.78
HTT P42858 4/20 0.78
L3MBTL1 Q9Y468 2/20 0.66
ALDH1A1 P00352 1/20 0.66
MCL1 Q07820 1/20 0.65
ADAMTS5 Q9UNA0 9/20 0.63
KDM1A O60341 1/20 0.58
ALOX12 P18054 2/20 0.58
HSPA5 P11021 1/20 0.58

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
SCHEMBL610570 0.92 RAB9A (0.69) RAB9ANPC1SMN1; SMN2LMNATDP1
SCHEMBL4044460 0.92 NPC1 (0.81) RAB9ANPC1SMN1; SMN2LMNATDP1
SCHEMBL15783174 0.91 RAB9A (1.00) RAB9ANPC1SMN1; SMN2LMNATDP1
SCHEMBL611157 0.90 ADAMTS5 (0.78) RAB9ANPC1SMN1; SMN2LMNATDP1
SCHEMBL610639 0.88 ADAMTS5 (0.68) RAB9ANPC1SMN1; SMN2LMNATDP1
SCHEMBL608538 0.88 NPC1 (1.00) RAB9ANPC1SMN1; SMN2LMNATDP1
SCHEMBL1815008 0.88 HSP90AA1 (0.77) RAB9ANPC1SMN1; SMN2HSP90AA1KDM4E
SCHEMBL1811921 0.87 ADAMTS5 (0.82) RAB9ANPC1SMN1; SMN2LMNATDP1
SCHEMBL608917 0.87 ADAMTS5 (0.78) RAB9ANPC1HSP90AA1KDM4EKMT2A
SCHEMBL1816178 0.87 NPC1 (0.73) RAB9ANPC1SMN1; SMN2LMNATDP1

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-20210198244-A1 SMALL MOLECULE ACTIVATORS OF MITOCHONDRIAL FUNCTION THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2021-07-01 US claimed
US-20170334890-A1 SMALL MOLECULE ACTIVATORS OF MITOCHONDRIAL FUNCTION THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2017-11-23 US claimed
US-9695157-B2 Small molecule activators of mitochondrial function THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2017-07-04 US claimed
US-20150210674-A1 SMALL MOLECULE ACTIVATORS OF MITOCHONDRIAL FUNCTION THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2015-07-30 US claimed
US-20120041023-A1 SMALL MOLECULE ACTIVATORS OF MITOCHONDRIAL FUNCTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-02-16 US claimed
WO-2010068767-A1 SMALL MOLECULE ACTIVATORS OF MITOCHONDRIAL FUNCTION THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2010-06-17 WO claimed
US-20210198244-A1 SMALL MOLECULE ACTIVATORS OF MITOCHONDRIAL FUNCTION THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2021-07-01 US disclosed
US-10745390-B2 Small molecule activators of mitochondrial function THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2020-08-18 US disclosed
US-20170334890-A1 SMALL MOLECULE ACTIVATORS OF MITOCHONDRIAL FUNCTION THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2017-11-23 US disclosed
US-9695157-B2 Small molecule activators of mitochondrial function THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2017-07-04 US disclosed
US-20150210674-A1 SMALL MOLECULE ACTIVATORS OF MITOCHONDRIAL FUNCTION THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2015-07-30 US disclosed
US-9000009-B2 Small molecule activators of mitochondrial function THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2015-04-07 US disclosed
US-20120041023-A1 SMALL MOLECULE ACTIVATORS OF MITOCHONDRIAL FUNCTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-02-16 US disclosed
WO-2010068767-A1 SMALL MOLECULE ACTIVATORS OF MITOCHONDRIAL FUNCTION THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2010-06-17 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-20150210674-A1 SMALL MOLECULE ACTIVATORS OF MITOCHONDRIAL FUNCTION TFAM, TFB2M, GFM1 RAB9A 1259/4885NPC1 1257/4885SMN1; SMN2 543/4885
US-20170334890-A1 SMALL MOLECULE ACTIVATORS OF MITOCHONDRIAL FUNCTION TFAM, TFB2M, GFM1 RAB9A 1259/4885NPC1 1257/4885SMN1; SMN2 543/4885
US-20120041023-A1 SMALL MOLECULE ACTIVATORS OF MITOCHONDRIAL FUNCTION TFAM, TFB2M, GFM1 RAB9A 1391/4885NPC1 1267/4885SMN1; SMN2 532/4885
US-10745390-B2 Small molecule activators of mitochondrial function TFAM, TFB2M, GFM1 RAB9A 1259/4885NPC1 1257/4885SMN1; SMN2 543/4885
US-20210198244-A1 SMALL MOLECULE ACTIVATORS OF MITOCHONDRIAL FUNCTION TFAM, TFB2M, GFM1 RAB9A 1259/4885NPC1 1257/4885SMN1; SMN2 543/4885

“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.