SCHEMBL15345467

SCHEMBL15345467

NCc1cc(Oc2ccccc2)cc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.44
LTA4H P09960 2/20 0.41
TSHR P16473 1/20 0.41
PLA2G2A P14555 1/20 0.41
ST14 Q9Y5Y6 1/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
NLRP3 Q96P20 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.39
MAOB P27338 1/20 0.39
HRH1 P35367 1/20 0.39
SCN9A Q15858 1/20 0.38

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
SCHEMBL15345314 0.83 MAOB (0.44) LTA4HPLA2G2AST14MEN1KMT2A
SCHEMBL25016073 0.83 L3MBTL1 (0.44) LTA4HTSHRMEN1NPC1RAB9A
SCHEMBL7654683 0.83 LTA4H (0.41) LTA4HTSHRMEN1NPC1RAB9A
SCHEMBL15345649 0.81 MEN1 (0.48) HTR2AMEN1KMT2A
SCHEMBL7650776 0.80 LTA4H (0.39) LTA4HTSHRMEN1NPC1RAB9A
SCHEMBL25016118 0.79 LTA4H (0.38) LTA4HTSHRKMT2A
SCHEMBL15345811 0.78 HTR2A (0.43) HTR2ALTA4HMEN1KMT2A
SCHEMBL7648253 0.78 LTA4H (0.36) LTA4HTSHRMEN1NPC1RAB9A
SCHEMBL15345592 0.77 HRH1 (0.50) LTA4HTSHRPLA2G2AHRH1
SCHEMBL7646978 0.76 LTA4H (0.35) LTA4HTSHRKMT2ATRPM8SCN9A

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 HTR2A 700/4885LTA4H 3106/4885TSHR 166/4885

“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.