SCHEMBL3440658

SCHEMBL3440658

COc1ccc(/C=C/C(=O)CC(=O)/C=C/c2ccc(OC)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 1.00
RAB9A P51151 2/20 0.73
NPC1 O15118 2/20 0.73
F3 P13726 2/20 0.72
HDAC3 O15379 3/20 0.71
HDAC1 Q13547 3/20 0.71
HDAC2 Q92769 3/20 0.71
HDAC8 Q9BY41 3/20 0.71
HDAC6 Q9UBN7 2/20 0.71
THRB P10828 1/20 0.70
ATM Q13315 1/20 0.70
HDAC4 P56524 1/20 0.65
HDAC7 Q8WUI4 1/20 0.65
HDAC10 Q969S8 1/20 0.65
HDAC11 Q96DB2 1/20 0.65
HDAC9 Q9UKV0 1/20 0.65
HDAC5 Q9UQL6 1/20 0.65
BACE1 P56817 4/20 0.64
CYP1A2 P05177 1/20 0.64
CYP2C19 P33261 1/20 0.64

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
SCHEMBL3440661 1.00 GSK3B (1.00) GSK3BRAB9ANPC1F3HDAC3
SCHEMBL10348539 0.93 GSK3B (0.87) GSK3BRAB9ANPC1F3HDAC3
SCHEMBL28550343 0.93 GSK3B (0.87) GSK3BRAB9ANPC1F3HDAC3
SCHEMBL11549072 0.93 GSK3B (0.87) GSK3BRAB9ANPC1F3HDAC3
SCHEMBL11549066 0.93 GSK3B (0.87) GSK3BRAB9ANPC1F3HDAC3
SCHEMBL14864159 0.93 GSK3B (0.87) GSK3BRAB9ANPC1F3HDAC3
SCHEMBL11778837 0.93 GSK3B (0.87) GSK3BRAB9ANPC1F3HDAC3
SCHEMBL10348538 0.93 GSK3B (0.87) GSK3BRAB9ANPC1F3HDAC3
SCHEMBL9414062 0.90 GSK3B (0.81) GSK3BRAB9ANPC1F3HDAC3
SCHEMBL9414059 0.90 GSK3B (0.81) GSK3BRAB9ANPC1F3HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230149499-A1 CURCUMIN COMPOSITIONS AND METHODS OF USE AS AN NK3 ANTAGONIST BONAFIDE HEALTH, LLC 2023-05-18 US disclosed
US-20160039734-A1 THERAPEUTIC CURCUMIN DERIVATIVES STC UNM (US) 2016-02-11 US disclosed
US-20160008297-A1 COMPOUNDS FOR PREVENTING, REDUCING AND/OR ALLEVIATING ITCHY SKIN CONDITION(S) B.R.A.I.N. BIOTECHNOLOGY RESEARCH AND INFORMATION NETWORK AG (DE) 2016-01-14 US disclosed
US-20160008297-A1 COMPOUNDS FOR PREVENTING, REDUCING AND/OR ALLEVIATING ITCHY SKIN CONDITION(S) B.R.A.I.N. BIOTECHNOLOGY RESEARCH AND INFORMATION NETWORK AG (DE) 2016-01-14 US disclosed
US-20160008297-A1 COMPOUNDS FOR PREVENTING, REDUCING AND/OR ALLEVIATING ITCHY SKIN CONDITION(S) B.R.A.I.N. BIOTECHNOLOGY RESEARCH AND INFORMATION NETWORK AG (DE) 2016-01-14 US disclosed
US-9187397-B2 Therapeutic curcumin derivatives STC.UNM (US) 2015-11-17 US disclosed
US-9074238-B2 Methods for enhancing neprilysin activity and degrading amyloid-beta peptides and oligomers in a subject with Alzheimer's disease ACADEMIA SINICA (TW) 2015-07-07 US disclosed
US-20150011494-A1 THERAPEUTIC CURCUMIN DERIVATIVES STC.UNM 2015-01-08 US disclosed
US-8841326-B2 Therapeutic curcumin derivatives STC.UNM (US) 2014-09-23 US disclosed
US-20130102498-A1 COMPOSITIONS AND METHODS FOR DETECTING AMYLOID-BETA-DEGRADING ENZYME ACTIVITY ACADEMIA SINICA (TW) 2013-04-25 US disclosed
US-8410177-B2 Curcumin derivatives INDIAN INSTITUTE OF TECHNOLOGY BOMBAY (IN) 2013-04-02 US disclosed
WO-2012143576-A2 COMPOUNDS FOR PREVENTING, REDUCING AND/OR ALLEVIATING ITCHY SKIN CONDITION(S) SYMRISE AG (DE) 2012-10-26 WO disclosed
WO-2011080550-A1 CURCUMIN DERIVATIVES INDIAN INSTITUTE OF TECHNOLOGY BOMBAY (IN) 2011-07-07 WO disclosed
US-20110160276-A1 CURCUMIN DERIVATIVES EMPIRE TECHNOLOGY DEVELOPMENT LLC 2011-06-30 US disclosed
US-7807230-B2 Curcumin and curcuminoid compounds, and use thereof as photosensitizers of onium salts RENSSELAER POLYTECHNIC INSTITUTE (US) 2010-10-05 US disclosed
US-7807230-B2 Curcumin and curcuminoid compounds, and use thereof as photosensitizers of onium salts RENSSELAER POLYTECHNIC INSTITUTE (US) 2010-10-05 US disclosed
US-20080260960-A1 Curcumin and Curcuminoid Compounds, and Use Thereof as Photosensitizers of Onium Salts RENSSELAER POLYTECHNIC INSTITUTE (US) 2008-10-23 US disclosed
US-20080260960-A1 Curcumin and Curcuminoid Compounds, and Use Thereof as Photosensitizers of Onium Salts RENSSELAER POLYTECHNIC INSTITUTE (US) 2008-10-23 US disclosed
US-20070060644-A1 Therapeutic curcumin derivatives STC.UNM 2007-03-15 US disclosed
US-20060276536-A1 Cancer treatment using curcumin derivatives STC.UNM 2006-12-07 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 (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-20230149499-A1 CURCUMIN COMPOSITIONS AND METHODS OF USE AS AN NK3 ANTAGONIST TAC3, PTGER3, TRPV3 GSK3B 3371/4885RAB9A 2762/4885NPC1 1302/4885
US-20110160276-A1 CURCUMIN DERIVATIVES CBR1, HMOX2, PTGS2 GSK3B 4405/4885RAB9A 2705/4885NPC1 2404/4885
US-20160039734-A1 THERAPEUTIC CURCUMIN DERIVATIVES FABP2, GLS2, FABP1 GSK3B 2812/4885RAB9A 2062/4885NPC1 275/4885
US-20070060644-A1 Therapeutic curcumin derivatives FABP2, GLS2, FABP1 GSK3B 2812/4885RAB9A 2062/4885NPC1 275/4885
US-20160008297-A1 COMPOUNDS FOR PREVENTING, REDUCING AND/OR ALLEVIATING ITCHY SKIN CONDITION(S) TRPV2, TRPV1, TRPM2 GSK3B 1637/4885RAB9A 2205/4885NPC1 958/4885
US-20150011494-A1 THERAPEUTIC CURCUMIN DERIVATIVES FABP2, GLS2, FABP1 GSK3B 2812/4885RAB9A 2062/4885NPC1 275/4885
US-20060276536-A1 Cancer treatment using curcumin derivatives BRCA1, VHL, TP53 GSK3B 3461/4885RAB9A 2661/4885NPC1 536/4885

“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.