Propanol

Propanol

SCHEMBL7455495

CCCCNC.CCCO

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.60
ALDH1A1 P00352 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
TSHR P16473 3/20 0.43
LMNA P02545 2/20 0.43
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ACHE P22303 2/20 0.40
ALOX15 P16050 1/20 0.37
S1PR2 O95136 5/20 0.37
S1PR4 O95977 5/20 0.37
S1PR1 P21453 5/20 0.37
S1PR3 Q99500 5/20 0.37
NAAA Q02083 1/20 0.37
S1PR5 Q9H228 1/20 0.37

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
Butyl Alcohol SCHEMBL9949408 0.92 ALDH1A1 (0.61) EPHX1ALDH1A1SMN1; SMN2TSHRLMNA
Propanol SCHEMBL9949497 0.92 EPHX1 (0.74) EPHX1ALDH1A1SMN1; SMN2TSHRLMNA
Alcohol SCHEMBL9949393 0.91
Propanol SCHEMBL9950933 0.89 EPHX1 (0.79) EPHX1ALDH1A1SMN1; SMN2TSHRLMNA
Propanol SCHEMBL9949577 0.89 EPHX1 (0.79) EPHX1ALDH1A1SMN1; SMN2TSHRLMNA
Propanol SCHEMBL9949383 0.89 EPHX1 (0.79) EPHX1ALDH1A1SMN1; SMN2TSHRLMNA
Propanol SCHEMBL1176412 0.89 EPHX1 (0.79) EPHX1ALDH1A1SMN1; SMN2TSHRLMNA
Propanol SCHEMBL9949752 0.89 EPHX1 (0.79) EPHX1ALDH1A1SMN1; SMN2TSHRLMNA
SCHEMBL2600 0.87
Bromide SCHEMBL22574897 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2705894-B1 Acid gas absorbent, acid gas removal method and acid gas removal device TOSHIBA KK (JP) 2018-05-23 EP disclosed
CN-106943848-A The method of carbon dioxide capture systems and operation carbon dioxide capture systems 株式会社东芝 2017-07-14 CN disclosed
EP-2784059-B1 Method for isolating tertiary amino alcohol TOSHIBA KK (JP) 2016-08-24 EP disclosed
US-9409119-B2 Acid gas absorbent, acid gas removal method, and acid gas removal device KABUSHIKI KAISHA TOSHIBA (JP) 2016-08-09 US disclosed
US-9181174-B2 Method for isolating tertiary amino alcohol KABUSHIKI KAISHA TOSHIBA (JP) 2015-11-10 US disclosed
US-20140296576-A1 METHOD FOR ISOLATING TERTIARY AMINO ALCOHOL KABUSHIKI KAISHA TOSHIBA (JP) 2014-10-02 US disclosed
EP-2784059-A1 Method for isolating tertiary amino alcohol Kabushiki Kaisha Toshiba (JP) 2014-10-01 EP disclosed
EP-2705894-A1 Acid gas absorbent, acid gas removal method and acid gas removal device Kabushiki Kaisha Toshiba (JP) 2014-03-12 EP disclosed
US-20120161071-A1 ACID GAS ABSORBENT, ACID GAS REMOVAL METHOD, AND ACID GAS REMOVAL DEVICE KABUSHIKI KAISHA TOSHIBA (JP) 2012-06-28 US disclosed
EP-2468385-A2 Acid gas absorbent, acid gas removal method and acid gas removal device Kabushiki Kaisha Toshiba (JP) 2012-06-27 EP disclosed
EP-0668271-B1 Process for the preparation of isocyanurate-group containing polyisocyanates BASF AG (DE) 2002-01-16 EP disclosed
US-5489663-A TRIMERIZING ALIPHATIC AND/OR CYCLOALIPHATIC DIISOCYANATES USING TETRAALKYLAMMONIUM ALKYL CARBONATE OR MIXTURES WITH QUATERNARY AMMONIOALKYL CARBONATE CATALYSTS, DEACTIVATING CATALYST BASF AKTIENGESELLSCHAFT (DE) 1996-02-06 US 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 (2 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-20140296576-A1 METHOD FOR ISOLATING TERTIARY AMINO ALCOHOL ADH1C, AADAT, ADH1A EPHX1 1763/4885ALDH1A1 48/4885SMN1; SMN2 2520/4885
US-20120161071-A1 ACID GAS ABSORBENT, ACID GAS REMOVAL METHOD, AND ACID GAS REMOVAL DEVICE ALKBH1, ALKBH3, ALKBH2 EPHX1 133/4885ALDH1A1 247/4885SMN1; SMN2 3228/4885

“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.