Phenol

Phenol

SCHEMBL1833980

NCCCC(N)CCCO.Oc1ccccc1

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH1 P35367 2/20 0.46
▸ HTR2A P28223 1/20 0.46
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ CA3 P07451 1/20 0.39
▸ CA4 P22748 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ CA14 Q9ULX7 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ S1PR2 O95136 1/20 0.36
▸ S1PR4 O95977 1/20 0.36
▸ S1PR1 P21453 1/20 0.36
▸ S1PR3 Q99500 1/20 0.36
▸ MMP2 P08253 2/20 0.35
▸ MAOA P21397 1/20 0.34

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
Benzoic Acid SCHEMBL5547713 0.89 DAO (0.40) HRH1HTR2ACA12CA1CA2
Phenol SCHEMBL11594523 0.82 TDP1 (0.52) HRH1HTR2ACA12CA1CA2
Benzoic Acid SCHEMBL1833791 0.81 DAO (0.45) HRH1HTR2ATDP1LMNAMMP2
Phthalic Acid SCHEMBL1832573 0.81 ALDH1A1 (0.45) HRH1HTR2AALDH1A1S1PR2S1PR4
SCHEMBL1832529 0.80 ALDH1A1 (0.37) HRH1HTR2ACA12CA1CA2
Salicylic Acid SCHEMBL1831848 0.80 ALDH1A1 (0.51) HRH1HTR2ACA12CA1CA2
Phenylacetic Acid SCHEMBL1833422 0.79 AKR1B1 (0.52) HRH1HTR2ALMNAS1PR2S1PR4
Iodide SCHEMBL1835199 0.78 ALDH1A1 (0.35) HRH1HTR2AALDH1A1
Bromide SCHEMBL1831768 0.78 ALDH1A1 (0.35) HRH1HTR2AALDH1A1
Hydrochloric Acid SCHEMBL1831383 0.78 ALDH1A1 (0.35) HRH1HTR2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9328220-B2 Liquids INNOVIA FILMS LIMITED (GB) 2016-05-03 — — US disclosed
US-8992798-B2 Liquids INNOVIA FILMS LIMITED (GB) 2015-03-31 — — US disclosed
US-8784686-B2 Liquids INNOVIA FILMS LIMITED (GB) 2014-07-22 — — US disclosed
US-20140187684-A1 LIQUIDS INNOVIA FILMS LIMITED (GB) 2014-07-03 — — US disclosed
US-20110257433-A1 LIQUIDS THE UNIVERSITY OF YORK (GB) 2011-10-20 — — US disclosed
EP-2322497-A1 Ionic liquids comprising nitrogen containing cations Innovia Films Limited (GB) 2011-05-18 — — EP disclosed
US-20080221361-A1 Ionic Liquids BIONIQS LIMITED (GB) 2008-09-11 — — US disclosed
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 — — US disclosed
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