SCHEMBL7114249

SCHEMBL7114249

COc1ccccc1CC1CO1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.50
ALDH1A1 P00352 3/20 0.47
GLA P06280 1/20 0.47
IDO1 P14902 2/20 0.47
TAAR1 Q96RJ0 1/20 0.47
SIGMAR1 Q99720 1/20 0.46
CHRM2 P08172 1/20 0.46
CHRM1 P11229 1/20 0.46
KCNH2 Q12809 1/20 0.45
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43

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
SCHEMBL3372443 0.85 ALDH1A1 (0.46) CYP2D6ALDH1A1GLASLC6A2SLC6A4
SCHEMBL6305830 0.85 ALDH1A1 (0.46) CYP2D6ALDH1A1GLASLC6A2SLC6A4
SCHEMBL1312619 0.85 ALDH1A1 (0.46) CYP2D6ALDH1A1GLASLC6A2SLC6A4
SCHEMBL11373613 0.83 HTR1A (0.41) CYP2D6ALDH1A1GLASLC6A2SLC6A4
SCHEMBL11357378 0.82 DRD4 (0.53) ALDH1A1TAAR1SIGMAR1KCNH2HRH3
SCHEMBL14199653 0.82 DRD4 (0.51) CYP2D6ALDH1A1GLAGAAMAPT
SCHEMBL16398404 0.82 CYP2D6 (0.45) CYP2D6ALDH1A1IDO1TAAR1SIGMAR1
SCHEMBL16398408 0.82 CYP2D6 (0.45) CYP2D6ALDH1A1IDO1TAAR1SIGMAR1
SCHEMBL7123430 0.81 ALDH1A1 (0.47) ALDH1A1GLAGAAMAPTHPGD
SCHEMBL7123428 0.81 ALDH1A1 (0.44) CYP2D6ALDH1A1GLACHRM2CHRM1

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
CN-118173384-A Conductive polymer dispersion, conductive polymer-containing liquid, conductive laminate, capacitor, and method for producing these 信越聚合物株式会社 2024-06-11 CN disclosed
CN-116042002-B Conductive polymer dispersion, conductive polymer-containing liquid, conductive laminate, capacitor, and method for producing these 信越聚合物株式会社 2024-06-11 CN disclosed
CN-116042002-A Conductive polymer dispersion, conductive polymer-containing liquid, conductive laminate, capacitor, and method for producing these 信越聚合物株式会社 2023-05-02 CN disclosed
CN-114479537-B Conductive polymer dispersion, conductive polymer-containing liquid, conductive laminate, capacitor, and methods for producing these 信越聚合物株式会社 2023-03-10 CN disclosed
CN-114479537-A Conductive polymer dispersion liquid, liquid containing conductive polymer, conductive laminate, capacitor, and methods for producing these 信越聚合物株式会社 2022-05-13 CN disclosed
US-6638970-B2 For protecting skeletal muscles against damage resulting from trauma or subsequent to muscle or systemic diseases such as intermittent claudication, for treating shock, cardiovascular disorders, for preserving donor tissue, organs in transplants CV THERAPEUTICS, INC. 2003-10-28 US disclosed
US-20010036961-A1 Substituted alkylene diamine compounds CV THERAPEUTICS, INC. 2001-11-01 US disclosed
WO-2001062711-A2 SUBSTITUTED ALKYLENE DIAMINE COMPOUNDS CV THERAPEUTICS, INC. (US) 2001-08-30 WO disclosed
US-4567264-A ADRENERGIC BLOCKING AGENTS SYNTEX (U.S.A.) INC. (US) 1986-01-28 US disclosed
EP-0126449-A1 Cardioselective aryloxy- and arylthio-hydroxypropyl piperazinyl acetanilides wich affect calcium entry SYNTEX (U.S.A.) INC. (US) 1984-11-28 EP disclosed
EP-0030030-A1 Derivatives of 2-aminoethanol, processes for their preparation, pharmaceutical compositions containing such compounds and the use the latter CIBA-GEIGY AG (CH) 1981-06-10 EP 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-20010036961-A1 Substituted alkylene diamine compounds TNNC1, CPT1B, TNNI3 CYP2D6 788/4885ALDH1A1 37/4885GLA 1005/4885

“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.