SCHEMBL15345592

SCHEMBL15345592

NCc1cc2ccccc2cc1Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.50
DPP4 P27487 1/20 0.47
CAMK2A Q9UQM7 1/20 0.42
LOXL2 Q9Y4K0 2/20 0.41
RHEB Q15382 1/20 0.41
LTA4H P09960 2/20 0.41
TSHR P16473 1/20 0.41
RIPK1 Q13546 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
PLA2G2A P14555 1/20 0.40
LOX P28300 1/20 0.40
TTR P02766 1/20 0.40
ADRA2C P18825 1/20 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
SCHEMBL15345380 0.78 NQO1 (0.50) CYP1A2
SCHEMBL1196716 0.78 HRH1 (0.71) HRH1DPP4LTA4HTSHRRIPK1
SCHEMBL15345394 0.77 HRH1 (0.54) HRH1DPP4LTA4HTSHRRIPK1
SCHEMBL15345467 0.77 HTR2A (0.44) HRH1LTA4HTSHRPLA2G2A
SCHEMBL1196987 0.77 CYP1A2 (0.62) HRH1DPP4RHEBSLC6A2SLC6A4
SCHEMBL20961847 0.76 HTR2A (0.48) DPP4LOXL2CYP3A4
Hydrochloric Acid SCHEMBL2462369 0.76 HRH1 (0.69) HRH1DPP4LTA4HTSHRRIPK1
SCHEMBL15345455 0.76 TLR8 (0.51) CYP1A2CYP3A4CYP2C19
SCHEMBL4209149 0.73 DPP4 (0.66) HRH1DPP4LTA4HTSHRRIPK1
SCHEMBL17048590 0.73 HRH1 (0.50) HRH1DPP4LOXL2RHEBLTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2657214-B1 PROCESS FOR PRODUCTION OF AROMATIC ALCOHOL OR HETEROCYCLIC AROMATIC ALCOHOL MITSUBISHI GAS CHEMICAL CO (JP) 2017-02-15 EP disclosed
US-8993774-B2 Process for production of aromatic alcohol or heterocyclic aromatic alcohol MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2015-03-31 US disclosed
US-20130303775-A1 PROCESS FOR PRODUCTION OF AROMATIC ALCOHOL OR HETEROCYCLIC AROMATIC ALCOHOL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2013-11-14 US disclosed
EP-2657214-A1 PROCESS FOR PRODUCTION OF AROMATIC ALCOHOL OR HETEROCYCLIC AROMATIC ALCOHOL Mitsubishi Gas Chemical Company, Inc. (JP) 2013-10-30 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-20130303775-A1 PROCESS FOR PRODUCTION OF AROMATIC ALCOHOL OR HETEROCYCLIC AROMATIC ALCOHOL ADH1C, ADH1A, ADH5 HRH1 67/4885DPP4 4821/4885CAMK2A 2849/4885

“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.