SCHEMBL10021976

SCHEMBL10021976

C/C=C1\CCC/C(=C\C)C1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.45
F3 P13726 2/20 0.43
EGFR P00533 1/20 0.41
NFE2L2 Q16236 1/20 0.41
MAPT P10636 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
HSD11B1 P28845 3/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
HTT P42858 2/20 0.40
CYP2C9 P11712 1/20 0.40
HSP90AA1 P07900 1/20 0.40
XBP1 P17861 1/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
NFKB1 P19838 2/20 0.39
NFKB2 Q00653 2/20 0.39
RELA Q04206 2/20 0.39

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
SCHEMBL13686073 1.00 CYP1A2 (0.45) CYP1A2F3EGFRNFE2L2MAPT
SCHEMBL17988234 1.00 CYP1A2 (0.45) CYP1A2F3EGFRNFE2L2MAPT
SCHEMBL13686075 0.88 CYP1A2 (0.39) CYP1A2F3MAPTSMN1; SMN2HSD11B1
SCHEMBL10021977 0.88 CYP1A2 (0.39) CYP1A2F3MAPTSMN1; SMN2HSD11B1
SCHEMBL13513062 0.87 ALDH1A1 (0.38) CYP1A2F3EGFRNFE2L2MAPT
SCHEMBL17975264 0.84 CYP1A2 (0.36) CYP1A2F3EGFRNFE2L2MAPT
SCHEMBL17975258 0.84 CYP1A2 (0.36) CYP1A2F3EGFRNFE2L2MAPT
SCHEMBL17975263 0.84 CYP1A2 (0.36) CYP1A2F3EGFRNFE2L2MAPT
SCHEMBL17975259 0.84 CYP1A2 (0.36) CYP1A2F3EGFRNFE2L2MAPT
SCHEMBL18574579 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230270689-A1 TREATMENT OF ALZHEIMER'S DISEASE KNEPPER PAUL A (US) 2023-08-31 US disclosed
US-20230270689-A1 TREATMENT OF ALZHEIMER'S DISEASE KNEPPER PAUL A (US) 2023-08-31 US disclosed
EP-4212151-A2 STILBENE, FLAVONOL OR CURCUMIN COMPOUNDS FOR USE IN THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION (AMD; ARMD) Knepper, Paul A. (US) 2023-07-19 EP disclosed
WO-2020167951-A1 COMPOSITION AND METHOD FOR INHIBITING PLATELET AGGREGATION KNEPPER PAUL A (US) 2020-08-20 WO disclosed
US-10744124-B2 Human therapeutic agents ANKH LIFE SCIENCES LIMITED (IE) 2020-08-18 US disclosed
US-20200147061-A1 HUMAN THERAPEUTIC AGENTS ANKH LIFE SCIENCES LIMITED (IE) 2020-05-14 US disclosed
EP-3275465-B1 THERAPEUTIC COMPOSITIONS COMPRISING A COMBINATION OF A HARMINE AND ISOVANILLIN COMPONENT ANKH LIFE SCIENCES LTD (IE) 2020-05-06 EP disclosed
US-10471049-B2 Therapeutic compositions containing harmine and isovanillin components, and methods of use thereof ANKH LIFE SCIENCES LIMITED (IE) 2019-11-12 US disclosed
US-20190231756-A1 THERAPEUTIC COMPOSITIONS CONTAINING HARMINE AND ISOVANILLIN COMPONENTS, AND METHODS OF USE THEREOF ANKH LIFE SCIENCES LIMITED (IE) 2019-08-01 US disclosed
EP-3188721-B1 HUMAN THERAPEUTIC AGENTS ANKH LIFE SCIENCES LTD (IE) 2019-06-12 EP disclosed
US-20140360366-A1 AZIDE CROSSLINKED AND PHYSICALLY CROSSLINKED POLYMERS FOR MEMBRANE SEPARATION DOW GLOBAL TECHNOLOGIES LLC (US) 2014-12-11 US disclosed
US-8841326-B2 Therapeutic curcumin derivatives STC.UNM (US) 2014-09-23 US disclosed
US-8841326-B2 Therapeutic curcumin derivatives STC.UNM (US) 2014-09-23 US disclosed
WO-2014047174-A1 RADIATION CURED MEMBRANES DERIVED FROM POLYMERS THAT ARE CO-REACTIVE WITH AZIDE CROSSLINKING AGENT(S) DOW GLOBAL TECHNOLOGIES LLC (US) 2014-03-27 WO disclosed
WO-2013043807-A1 AZIDE CROSSLINKED AND PHYSICALLY CROSSLINKED POLYMERS FOR MEMBRANE SEPARATION DOW GLOBAL TECHNOLOGIES LLC (US) 2013-03-28 WO disclosed
US-8119041-B2 A polymerizable monomer or polymerizable oligomer and at least a two-photon absorption material containing aliphatic ketone compounds with atleast 2-8 double bonds and two aromatic or heteroaromatic rings FUJIFILM CORPORATION (JP) 2012-02-21 US disclosed
US-20110065126-A1 SUBSTANCE-IMMOBILIZING SUBSTRATE, SUBSTANCE-IMMOBILIZED SUBTRATE, AND ANALYSIS METHOD RIKEN (JP) 2011-03-17 US disclosed
US-20110065126-A1 SUBSTANCE-IMMOBILIZING SUBSTRATE, SUBSTANCE-IMMOBILIZED SUBTRATE, AND ANALYSIS METHOD RIKEN (JP) 2011-03-17 US disclosed
US-20070060644-A1 Therapeutic curcumin derivatives STC.UNM 2007-03-15 US disclosed
US-20070060644-A1 Therapeutic curcumin derivatives STC.UNM 2007-03-15 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 (6 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-10744124-B2 Human therapeutic agents INMT, HNMT, HASPIN CYP1A2 2166/4885F3 4264/4885EGFR 3201/4885
US-20190231756-A1 THERAPEUTIC COMPOSITIONS CONTAINING HARMINE AND ISOVANILLIN COMPONENTS, AND METHODS OF USE THEREOF INMT, HNMT, COMT CYP1A2 1507/4885F3 4252/4885EGFR 3882/4885
US-20070060644-A1 Therapeutic curcumin derivatives FABP2, GLS2, FABP1 CYP1A2 2544/4885F3 4781/4885EGFR 4187/4885
US-10471049-B2 Therapeutic compositions containing harmine and isovanillin components, and methods of use thereof INMT, HNMT, COMT CYP1A2 1507/4885F3 4252/4885EGFR 3882/4885
US-20200147061-A1 HUMAN THERAPEUTIC AGENTS INMT, HNMT, HASPIN CYP1A2 2166/4885F3 4264/4885EGFR 3201/4885
US-20230270689-A1 TREATMENT OF ALZHEIMER'S DISEASE TLR4, TLR2, PSEN2 CYP1A2 2074/4885F3 4094/4885EGFR 3856/4885

“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.