SCHEMBL3687134

SCHEMBL3687134

COc1cccc(C=CC(=O)O)c1O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.66
BACE1 P56817 1/20 0.62
TLR2 O60603 1/20 0.62
ERN1 O75460 1/20 0.62
TLR1 Q15399 1/20 0.62
TLR6 Q9Y2C9 1/20 0.62
BCHE P06276 2/20 0.59
TXNRD1 Q16881 1/20 0.59
TXNRD3 Q86VQ6 1/20 0.59
TXNRD2 Q9NNW7 1/20 0.59
MAPT P10636 5/20 0.58
APP P05067 1/20 0.58
GAA P10253 2/20 0.57
NFE2L2 Q16236 3/20 0.56
TFEB P19484 1/20 0.56
ABL1 P00519 1/20 0.55
ABCB1 P08183 1/20 0.55
BCR P11274 1/20 0.55
RAB9A P51151 3/20 0.54
POLB P06746 2/20 0.54

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
SCHEMBL3687130 1.00 KDM4E (0.66) KDM4EBACE1TLR2ERN1TLR1
SCHEMBL11260283 0.87 KDM4E (0.73) KDM4EBACE1TLR2ERN1TLR1
SCHEMBL11260285 0.87 KDM4E (0.73) KDM4EBACE1TLR2ERN1TLR1
SCHEMBL7724020 0.85 BACE1 (0.82) KDM4EBACE1TLR2ERN1TLR1
SCHEMBL7724027 0.85 BACE1 (0.82) KDM4EBACE1TLR2ERN1TLR1
SCHEMBL9689786 0.85 KDM4E (0.68) KDM4EBCHEMAPTGAANFE2L2
SCHEMBL21317661 0.85 PKM (0.56) KDM4EBACE1MAPTAPPGAA
SCHEMBL16831490 0.85 KDM4E (0.68) KDM4EBCHEMAPTGAANFE2L2
SCHEMBL5084154 0.84 MAPT (0.78) BACE1BCHEMAPTRAB9ASMN1; SMN2
SCHEMBL5084150 0.84 MAPT (0.78) BACE1BCHEMAPTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025081932-A1 RETINOL DERIVATIVE OR SALT THEREOF, AS WELL AS PREPARATION METHOD THEREFOR AND USE THEREOF 深圳市护家科技有限公司 2025-04-24 WO claimed
CN-119841755-A Retinol derivative or its salt, and preparation method and application thereof 深圳市护家科技有限公司 2025-04-18 CN claimed
WO-2025081932-A1 RETINOL DERIVATIVE OR SALT THEREOF, AS WELL AS PREPARATION METHOD THEREFOR AND USE THEREOF 深圳市护家科技有限公司 2025-04-24 WO disclosed
CN-119841755-A Retinol derivative or its salt, and preparation method and application thereof 深圳市护家科技有限公司 2025-04-18 CN disclosed
US-7795310-B2 Methods and reagents for the treatment of metabolic disorders COMBINATORX, INC. (US) 2010-09-14 US disclosed
EP-1781303-A4 METHODS AND REAGENTS FOR THE TREATMENT OF METABOLIC DISORDERS COMBINATORX INC (US) 2008-07-02 EP disclosed
EP-1781303-A1 METHODS AND REAGENTS FOR THE TREATMENT OF METABOLIC DISORDERS CombinatoRx, Incorporated (US) 2007-05-09 EP disclosed
US-20060069161-A1 Methods and reagents for the treatment of metabolic disorders COMBINATORX, INC. (US) 2006-03-30 US disclosed
WO-2006004803-A1 METHODS AND REAGENTS FOR THE TREATMENT OF METABOLIC DISORDERS COMBINATORX, INCORPORATED (US) 2006-01-12 WO disclosed
US-4981773-A Method for stabilization of organic base substances against light FUJI PHOTO FILM CO., LTD. (JP) 1991-01-01 US disclosed
US-4026896-A ANTIALLERGENS KISSEI YAKUHIN KOGYO KABUSHIKI KAISHA (KISSEI PHARMACEUTICAL CO. LTD.) (JA) 1977-05-31 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 (1 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-20060069161-A1 Methods and reagents for the treatment of metabolic disorders LIPC, PNLIP, GOT2 KDM4E 3045/4885BACE1 3331/4885TLR2 4268/4885

“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.