SCHEMBL460126

SCHEMBL460126

OC1CCc2ccccc2O1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.44
HTR1A P08908 3/20 0.42
SIGMAR1 Q99720 2/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
NISCH Q9Y2I1 1/20 0.41
HTR1D P28221 1/20 0.39
ANPEP P15144 1/20 0.39
SSTR4 P31391 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
ESR1 P03372 2/20 0.39
ESR2 Q92731 2/20 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
SCHEMBL30070640 1.00 CA2 (0.44) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL8981650 0.93 CA2 (0.40) CA2HTR1ASIGMAR1ADRA2AADRA2B
Phosphoric Acid SCHEMBL4393635 0.91 CA2 (0.42) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL16964715 0.88 TSHR (0.39) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL29767007 0.86 CA2 (0.41) CA2HTR1ASIGMAR1ADRA2AADRA2B
Propionic Acid SCHEMBL28970782 0.85 CA2 (0.42) CA2HTR1ASIGMAR1ADRA2AADRA2B
Salicylic Acid SCHEMBL7597669 0.82 ALDH1A1 (0.50) CA2HTR1ASIGMAR1ADRA2AADRA2B
Flavane SCHEMBL26661841 0.79 ESR1 (0.54) MAOBESR1ESR2
SCHEMBL19268290 0.78 MAOA (0.45) NISCHMAOAMAOB
SCHEMBL458951 0.78 MAOA (0.45) NISCHMAOAMAOB

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 382 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109160911-A A kind of preparation method of nebivolol 雅本化学股份有限公司 2019-01-08 CN claimed
US-20180325164-A1 LIQUID FORMULATION JAYTEE BIOSCIENCES LIMITED (GB) 2018-11-15 US claimed
EP-3373974-A1 LIQUID FORMULATION Jaytee Biosciences Limited (GB) 2018-09-19 EP claimed
WO-2017081480-A1 LIQUID FORMULATION JAYTEE BIOSCIENCES LIMITED (GB) 2017-05-18 WO claimed
EP-2308496-B1 Formulation containing phosphate derivatives of electron transfer agents VITAL HEALTH SCIENCES PTY LTD (AU) 2015-04-15 EP claimed
EP-2531219-A1 CARRIER COMPOSITION Phosphagenics Limited (AU) 2012-12-12 EP claimed
EP-2516011-A1 CARRIER COMPOSITION Phosphagenics Limited (AU) 2012-10-31 EP claimed
US-20120202780-A1 CARRIER COMPOSITION PHOSPHAGENICS LIMITED (AU) 2012-08-09 US claimed
EP-1339412-B1 FORMULATION CONTAINING PHOSPHATE DERIVATIVES OF ELECTRON TRANSFER AGENTS VITAL HEALTH SCIENCES PTY LTD (AU) 2011-11-02 EP claimed
WO-2011094822-A1 CARRIER COMPOSITION PHOSPHAGENICS LIMITED (AU) 2011-08-11 WO claimed
EP-1227104-A1 PROCESSES FOR PRODUCING AND PURIFYING ASPARTAME DERIVATIVES AND PROCESS FOR PRODUCING PRODUCTION INTERMEDIATES Ajinomoto Co., Inc. (JP) 2002-07-31 EP claimed
EP-1163010-A1 HEMOGLOBIN-ANTIOXIDANT CONJUGATES HEMOSOL INC. (CA) 2001-12-19 EP claimed
WO-2001094331-A2 METHODS FOR PRODUCING AMINO-SUBSTITUTED CHROMANES ELI LILLY & COMPANY (US) 2001-12-13 WO claimed
WO-2001094330-A2 METHODS FOR PRODUCING AMINO SUBSTITUTED CHROMANES COR THERAPEUTICS, INC. (US) 2001-12-13 WO claimed
WO-2001087871-A2 METHODS FOR PRODUCING AMINO SUBSTITUTED CHROMANES AND INTERMEDIATES THEREFOR MILLENNIUM PHARMACEUTICALS, INC. (US) 2001-11-22 WO claimed
WO-2000056367-A1 HEMOGLOBIN-ANTIOXIDANT CONJUGATES HEMOSOL INC. (CA) 2000-09-28 WO claimed
CN-1249306-A Process for preparing benzodihydropyranol deriv. BASF AG (DE) 2000-04-05 CN claimed
CN-1218050-A Sulfonamide-substituted benzopyran derivates processes for their preparation, their use as medicament, and pharmaceutical preparations comprising them HOECHST MARION ROUSSEL DE GMBH (DE) 1999-06-02 CN claimed
EP-0385584-B1 Method for the preparation of 4-(cyclic-amido)-2H-1-benzopyrans and 4-amino-3-hydroxy-2H-1-benzopyrans BEECHAM GROUP PLC (GB) 1995-05-24 EP claimed
US-5126460-A PROCESS FOR PREPARING BENZOYPYRANOL DERIVATIVES BEECHAM GROUP P.L.C. (GB) 1992-06-30 US claimed

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-20120202780-A1 CARRIER COMPOSITION SLC35B2, SLC34A2, SLC20A2 CA2 1221/4885HTR1A 3306/4885SIGMAR1 1761/4885

“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.