SCHEMBL4037170

SCHEMBL4037170

CC(=O)c1cc(I)ccc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.47
ERN1 O75460 1/20 0.45
HTT P42858 1/20 0.44
MAOA P21397 2/20 0.41
MAOB P27338 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
MAPK1 P28482 2/20 0.41
MAPT P10636 2/20 0.41
MCL1 Q07820 2/20 0.41
CYP3A4 P08684 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
NSD2 O96028 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
CSNK2A1 P68400 1/20 0.41
GAA P10253 1/20 0.40
ALOX15 P16050 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL30832900 1.00 AR (0.47) ARERN1HTTMAOAMAOB
SCHEMBL3341120 0.83 ALDH1A1 (0.55) ERN1HTTMAOAMAOBALDH1A1
SCHEMBL21592065 0.82 PTPRC (0.40) ARERN1HTTALDH1A1HPGD
SCHEMBL24195885 0.80 PTPRC (0.39) ARERN1ALDH1A1HPGDMAPK1
SCHEMBL129664 0.80 CA1 (0.61) ARHTTALDH1A1HPGDMCL1
SCHEMBL29662013 0.80 CA1 (0.61) ARHTTALDH1A1HPGDMCL1
SCHEMBL2724088 0.79 RAB9A (0.52) MAPTPOLBKMT2AALOX15SMN1; SMN2
SCHEMBL2724086 0.79 LMNA (0.53) HTTALDH1A1HPGDMAPK1KDM4E
SCHEMBL11449959 0.78 AR (0.47) ARERN1HTTALDH1A1HPGD
SCHEMBL23242473 0.78 AR (0.47) ARERN1HTTALDH1A1HPGD

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250276962-A1 CONTRACEPTIVE COMPOUNDS AND METHODS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2025-09-04 US disclosed
US-12281105-B2 Contraceptive compounds and methods REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2025-04-22 US disclosed
US-20250114345-A1 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF ONCOPIA THERAPEUTICS, INC. D/B/A/ SK LIFE SCIENCE LABS 2025-04-10 US disclosed
WO-2025049994-A1 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF ONCOPIA THERAPEUTICS, INC. D/B/A SK LIFE SCIENCE LABS (US) 2025-03-06 WO disclosed
US-20240391928-A1 COMPOSITIONS FOR THE TREATMENT OF FOOD AND CHEMICAL ADDICTION AND METHODS OF MAKING AND USING SAME UNIV DUKE (US) 2024-11-28 US disclosed
EP-4404926-A1 COMPOSITIONS FOR THE TREATMENT OF FOOD AND CHEMICAL ADDICTION AND METHODS OF MAKING AND USING SAME Duke University (US) 2024-07-31 EP disclosed
CN-117881674-A Contraceptive compounds and methods 明尼苏达大学董事会 2024-04-12 CN disclosed
US-20240109872-A1 CONTRACEPTIVE COMPOUNDS AND METHODS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2024-04-04 US disclosed
CN-116964044-A Acetamido-phenyltetrazole derivatives and methods of use thereof 希华医药有限公司 2023-10-27 CN disclosed
US-11780828-B2 Contraceptive compounds and methods REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2023-10-10 US disclosed
US-7390803-B2 Tetrahydropyranyl cyclopentyl benzylamide modulators of chemokine receptor activity MERCK & CO., INC. (US) 2008-06-24 US disclosed
US-7390803-B2 Tetrahydropyranyl cyclopentyl benzylamide modulators of chemokine receptor activity MERCK & CO., INC. (US) 2008-06-24 US disclosed
EP-1534698-B1 FLAVONOID COMPOUNDS AS THERAPEUTIC ANTIOXIDANTS ROWETT RES INST (GB) 2007-09-19 EP disclosed
US-20060137207-A1 Flavonoid compounds as therapeutic antioxidants ANTOXIS LIMITED (GB) 2006-06-29 US disclosed
EP-1534698-A1 FLAVONOID COMPOUNDS AS THERAPEUTIC ANTIOXIDANTS The Rowett Research Institute (GB) 2005-06-01 EP disclosed
WO-2004007475-A1 FLAVONOID COMPOUNDS AS THERAPEUTIC ANTIOXIDANTS ROWETT RESEARCH INSTITUTE (GB) 2004-01-22 WO disclosed
US-6552071-B2 Wedelolactone and its synthesis for treating neurodegenerative diseases PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2003-04-22 US disclosed
EP-1237550-A2 METHODS FOR TREATING CELL DEATH DISEASES AND INFLAMMATION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2002-09-11 EP disclosed
US-20020049251-A1 Methods for treating cell death diseases and inflammation HARVARD COLLEGE, PRESIDENT AND FELLOWS 2002-04-25 US disclosed
WO-2001041709-A2 METHODS FOR TREATING CELL DEATH DISEASES AND INFLAMMATION PRESIDENT AND FELLOWS OF HARWARD COLLEGE (US) 2001-06-14 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 (7 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-20250276962-A1 CONTRACEPTIVE COMPOUNDS AND METHODS CYP19A1, GNRHR, NR5A1 AR 99/4885ERN1 1811/4885HTT 3208/4885
US-11780828-B2 Contraceptive compounds and methods CYP19A1, GNRHR, NR5A1 AR 99/4885ERN1 1811/4885HTT 3208/4885
US-20020049251-A1 Methods for treating cell death diseases and inflammation CASP3, CASP9, CASP2 AR 3261/4885ERN1 868/4885HTT 947/4885
US-20240391928-A1 COMPOSITIONS FOR THE TREATMENT OF FOOD AND CHEMICAL ADDICTION AND METHODS OF MAKING AND USING SAME PNMT, DBH, COMT AR 3178/4885ERN1 1146/4885HTT 320/4885
US-20250114345-A1 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF EP300, CREBBP, HDAC1 AR 743/4885ERN1 2404/4885HTT 1351/4885
US-20240109872-A1 CONTRACEPTIVE COMPOUNDS AND METHODS CYP19A1, GNRHR, NR5A1 AR 99/4885ERN1 1811/4885HTT 3208/4885
US-12281105-B2 Contraceptive compounds and methods CYP19A1, GNRHR, NR5A1 AR 99/4885ERN1 1811/4885HTT 3208/4885

“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.