SCHEMBL173089

SCHEMBL173089

COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OCCN(C)C

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.75
TP53 P04637 3/20 0.75
HSD17B10 Q99714 3/20 0.75
SMN1; SMN2 Q16637 2/20 0.75
MAPT P10636 2/20 0.75
LMNA P02545 2/20 0.75
CYP1A2 P05177 1/20 0.75
HIF1A Q16665 1/20 0.75
PSMB11 A5LHX3 1/20 0.75
PSMA7 O14818 1/20 0.75
NPC1 O15118 1/20 0.75
FOXO3 O43524 1/20 0.75
MITF O75030 1/20 0.75
CYP3A4 P08684 1/20 0.75
PSMB1 P20618 1/20 0.75
PSMA1 P25786 1/20 0.75
PSMA2 P25787 1/20 0.75
PSMA3 P25788 1/20 0.75
PSMA4 P25789 1/20 0.75
PSMB8 P28062 1/20 0.75

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
SCHEMBL98825 0.95 ALDH1A1 (0.68) ALDH1A1TP53HSD17B10SMN1; SMN2MAPT
SCHEMBL15444220 0.94 ALDH1A1 (0.75) ALDH1A1TP53HSD17B10SMN1; SMN2MAPT
SCHEMBL15444232 0.93 ALDH1A1 (0.77) ALDH1A1TP53HSD17B10SMN1; SMN2MAPT
SCHEMBL15432094 0.90 ALDH1A1 (0.68) ALDH1A1TP53HSD17B10SMN1; SMN2MAPT
SCHEMBL15432212 0.90 ALDH1A1 (0.68) ALDH1A1TP53HSD17B10SMN1; SMN2MAPT
SCHEMBL19295194 0.89 ALDH1A1 (0.80) ALDH1A1TP53HSD17B10SMN1; SMN2MAPT
SCHEMBL15432063 0.89 ALDH1A1 (0.70) ALDH1A1TP53HSD17B10SMN1; SMN2MAPT
SCHEMBL173087 0.88 ALDH1A1 (0.78) ALDH1A1TP53HSD17B10SMN1; SMN2MAPT
SCHEMBL173120 0.87 ALDH1A1 (0.65) ALDH1A1TP53HSD17B10SMN1; SMN2MAPT
SCHEMBL173090 0.86 ALDH1A1 (0.83) ALDH1A1TP53HSD17B10SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10758524-B2 Compositions and methods for selectively depleting senescent cells BIOVENTURES, LLC (US) 2020-09-01 US disclosed
US-10548911-B2 Small molecule anti-scarring agents UNIVERSITY OF ROCHESTER (US) 2020-02-04 US disclosed
US-20170246155-A1 COMPOSITIONS AND METHODS FOR SELECTIVELY DEPLETING SENESCENT CELLS BIOVENTURES, LLC 2017-08-31 US disclosed
US-20170246155-A1 COMPOSITIONS AND METHODS FOR SELECTIVELY DEPLETING SENESCENT CELLS BIOVENTURES, LLC 2017-08-31 US disclosed
US-20170216332-A1 SMALL MOLECULE ANTI-SCARRING AGENTS UNIVERSITY OF ROCHESTER (US) 2017-08-03 US disclosed
WO-2015195684-A2 SMALL MOLECULE ANTI-SCARRING AGENTS UNIVERSITY OF ROCHESTER (US) 2015-12-23 WO disclosed
US-9108923-B2 Compounds, compositions, and methods for cancer therapy HOWARD HUGHES MEDICAL INSTITUTE (US) 2015-08-18 US disclosed
US-20140024639-A1 Compounds, Compositions, and Methods for Cancer Therapy NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2014-01-23 US disclosed
US-20130237539-A1 Compounds and Compositions for Treating Cancer THE GENERAL HOSPITAL CORPORATION (US) 2013-09-12 US disclosed
US-20130203757-A1 Compounds And Compositions For Treating Cancer THE GENERAL HOSPITAL CORPORATION (US) 2013-08-08 US disclosed
US-8349832-B2 Compounds and compositions for treating cancer Canthera Therapeutics (US) 2013-01-08 US disclosed
US-8318737-B2 Compounds and compositions for treating cancer CANTHERA THERAPEUTICS INC. (US) 2012-11-27 US disclosed
US-20120157455-A1 Compounds And Compositions For Treating Cancer CANTHERA THERAPEUTICS, INC. (US) 2012-06-21 US disclosed
WO-2012030408-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CANCER CANTHERA THERAPEUTICS, INC. (US) 2012-03-08 WO disclosed
US-20120059004-A1 Compounds And Compositions For Treating Cancer CANTHERA THERAPEUTICS, INC. (US) 2012-03-08 US disclosed
WO-2011028860-A2 COMPOUNDS AND COMPOSITIONS FOR TREATING CANCER CANTHERA THERAPEUTICS, INC. (US) 2011-03-10 WO disclosed
US-20110053938-A1 Compounds and Compositions For Treating Cancer CANTHERA THERAPEUTICS, INC. (US) 2011-03-03 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 (10 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-20170216332-A1 SMALL MOLECULE ANTI-SCARRING AGENTS COLGALT1, MMP1, FIBP ALDH1A1 970/4885TP53 2310/4885HSD17B10 1565/4885
US-10758524-B2 Compositions and methods for selectively depleting senescent cells CD47, MCL1, LIMS1 ALDH1A1 1334/4885TP53 4/4885HSD17B10 4383/4885
US-20140024639-A1 Compounds, Compositions, and Methods for Cancer Therapy MCL1, TP53, VHL ALDH1A1 710/4885TP53 2/4885HSD17B10 4333/4885
US-20170246155-A1 COMPOSITIONS AND METHODS FOR SELECTIVELY DEPLETING SENESCENT CELLS CD47, MCL1, LIMS1 ALDH1A1 1334/4885TP53 4/4885HSD17B10 4383/4885
US-20120059004-A1 Compounds And Compositions For Treating Cancer NQO1, HCCS, TXNRD2 ALDH1A1 503/4885TP53 7/4885HSD17B10 1659/4885
US-20130203757-A1 Compounds And Compositions For Treating Cancer NQO1, HCCS, TXNRD2 ALDH1A1 503/4885TP53 7/4885HSD17B10 1659/4885
US-20110053938-A1 Compounds and Compositions For Treating Cancer NQO1, HCCS, TXNRD2 ALDH1A1 503/4885TP53 7/4885HSD17B10 1659/4885
US-20130237539-A1 Compounds and Compositions for Treating Cancer NQO1, HCCS, TXNRD2 ALDH1A1 503/4885TP53 7/4885HSD17B10 1659/4885
US-20120157455-A1 Compounds And Compositions For Treating Cancer NQO1, HCCS, TXNRD2 ALDH1A1 503/4885TP53 7/4885HSD17B10 1659/4885
US-10548911-B2 Small molecule anti-scarring agents COLGALT1, MMP1, FIBP ALDH1A1 970/4885TP53 2310/4885HSD17B10 1565/4885

“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.