SCHEMBL15345310

SCHEMBL15345310

NCc1cccc2cccc(O)c12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 4/20 0.55
ALDH1A1 P00352 2/20 0.45
MEN1 O00255 1/20 0.45
DNMT1 P26358 1/20 0.45
CACNA1B Q00975 1/20 0.45
APBA1 Q02410 1/20 0.45
KMT2A Q03164 1/20 0.45
MCL1 Q07820 1/20 0.45
APOBEC3G Q9HC16 1/20 0.45
TAAR1 Q96RJ0 2/20 0.43
HTR2C P28335 1/20 0.41
PNMT P11086 2/20 0.40
HSPA5 P11021 1/20 0.39
MAPT P10636 2/20 0.38
CDK2 P24941 1/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
CYP1A2 P05177 1/20 0.38
APP P05067 1/20 0.38
THRB P10828 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
SCHEMBL31284939 0.84 PNMT (0.48) HTR2AALDH1A1MCL1PNMTCYP1A2
SCHEMBL9817745 0.84 PNMT (0.48) HTR2AALDH1A1MCL1PNMTCYP1A2
SCHEMBL8402119 0.80 HTR2A (0.56) HTR2AALDH1A1MEN1DNMT1CACNA1B
SCHEMBL3960209 0.78 HTR2A (0.59) HTR2AALDH1A1MEN1DNMT1CACNA1B
SCHEMBL27366565 0.77 HTR2A (0.62) HTR2AALDH1A1MEN1DNMT1CACNA1B
SCHEMBL70219 0.75 ALDH1A1 (0.62) HTR2AALDH1A1MEN1DNMT1CACNA1B
SCHEMBL29363189 0.75 ALDH1A1 (0.62) HTR2AALDH1A1MEN1DNMT1CACNA1B
SCHEMBL366656 0.75 ADAMTS4 (0.52) ALDH1A1TAAR1PNMTHSPA5CDK2
SCHEMBL15345589 0.74 TAAR1 (0.43) HTR2AALDH1A1TAAR1PNMTCYP1A2
SCHEMBL15345556 0.74 TAAR1 (0.45) HTR2AALDH1A1TAAR1PNMTCYP1A2

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 700/4885ALDH1A1 250/4885MEN1 1563/4885

“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.