SCHEMBL2092235

SCHEMBL2092235

O=C(O)COC1CCc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.53
FFAR1 O14842 4/20 0.48
GPR84 Q9NQS5 1/20 0.45
ATM Q13315 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
PIN1 Q13526 2/20 0.41
HTR2C P28335 2/20 0.40
SLC6A3 Q01959 1/20 0.40
CD69 Q07108 1/20 0.40
OPRM1 P35372 1/20 0.40
DRD3 P35462 1/20 0.40
AVPR1A P37288 1/20 0.40
OPRK1 P41145 1/20 0.40

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
SCHEMBL30639030 1.00 IDO1 (0.53) IDO1FFAR1GPR84ATMPTGDR2
SCHEMBL9363921 0.91 IDO1 (0.55) IDO1FFAR1GPR84PTGDR2
SCHEMBL11658615 0.86 IDO1 (0.56) IDO1FFAR1GPR84ATMCYP11B1
SCHEMBL11025088 0.82 HTR2C (0.49) IDO1FFAR1GPR84ATMHTR2C
Acetic Acid SCHEMBL27529459 0.81 FFAR1 (0.52) IDO1FFAR1GPR84ATMPIN1
SCHEMBL11258276 0.81 FFAR1 (0.46) IDO1FFAR1GPR84PIN1
SCHEMBL1746407 0.80 FFAR1 (0.60) IDO1FFAR1PTGDR2
SCHEMBL7846356 0.80 HTR2C (0.53) IDO1FFAR1GPR84HTR2CSLC6A3
SCHEMBL7258599 0.79 IDO1 (0.63) IDO1GPR84CYP11B2
SCHEMBL31072335 0.78 IDO1 (0.50) IDO1FFAR1ATMHTR2CSLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020227344-A1 CHLORIDE INTRACELLULAR CHANNEL 1 FOR REGULATION OF FOOD INTAKE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-11-12 WO claimed
EP-2934110-B1 USE OF CONNEXIN CHANNEL INHIBITORS TO PROTECT GRAFTS UNIV GENT (BE) 2018-08-01 EP claimed
US-9485983-B2 Use of connexin channel inhibitors to protect grafts UNIVERSITEIT GENT (BE) 2016-11-08 US claimed
US-20150313208-A1 USE OF CONNEXIN CHANNEL INHIBITORS TO PROTECT GRAFTS UNIVERSITEIT GENT (BE) 2015-11-05 US claimed
EP-2934110-A1 USE OF CONNEXIN CHANNEL INHIBITORS TO PROTECT GRAFTS Universiteit Gent (BE) 2015-10-28 EP claimed
WO-2014095468-A1 USE OF CONNEXIN CHANNEL INHIBITORS TO PROTECT GRAFTS UNIVERSITEIT GENT (BE) 2014-06-26 WO claimed
US-20140024683-A1 CHLORIDE CHANNEL AND CHLORIDE TRANSPORTER MODULATORS FOR THERAPY IN SMOOTH MUSCLE DISEASES NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2014-01-23 US claimed
WO-2012134965-A1 CHLORIDE CHANNEL AND CHLORIDE TRANSPORTER MODULATORS FOR THERAPY IN SMOOTH MUSCLE DISEASES THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2012-10-04 WO claimed
US-20100168030-A1 Methods and compositions for treatment of organophosphate-caused pathology ARMY, UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE 2010-07-01 US claimed
US-20090220516-A1 Neuroprotection of retinal ganglion cells NATIONAL INSTITUTES OF HEALTH-DIRECTOR DEITR 2009-09-03 US claimed
WO-2007002139-A2 NEUROPROTECTION OF RETINAL GANGLION CELLS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2007-01-04 WO claimed
EP-0786994-B1 USE OF CHLORIDE CHANNEL BLOCKERS FOR REDUCING INTRAOCULAR PRESSURE ALLERGAN INC (US) 2004-11-03 EP claimed
US-5705530-A SIDE EFFECT REDUCTION; GLAUCOMA TREATMENT ALLERGAN (US) 1998-01-06 US claimed
EP-0786994-A2 USE OF CHLORIDE CHANNEL BLOCKERS FOR REDUCING INTRAOCULAR PRESSURE Allergan (US) 1997-08-06 EP claimed
US-5559151-A Method for reducing intraocular pressure in the mammalian eye by administration of chloride channel blockers ALLERGAN (US) 1996-09-24 US claimed
WO-1996016647-A2 USE OF CHLORIDE CHANNEL BLOCKERS FOR REDUCING INTRAOCULAR PRESSURE ALLERGAN (US) 1996-06-06 WO claimed
EP-0330380-B1 NOVEL INDANOXYACETIC ACID DERIVATIVES AND PROCESSES FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 1993-06-23 EP claimed
US-4975460-A INHIBITION OF PLATELET AGGREGATION TANABE SEIYAKU CO., LTD. (JP) 1990-12-04 US claimed
EP-0330380-A2 Novel indanoxyacetic acid derivatives and processes for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1989-08-30 EP claimed
US-4334088-A 2-Alkynyl-5-indanyloxyacetic acids MEAD JOHNSON & COMPANY (US) 1982-06-08 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-20140024683-A1 CHLORIDE CHANNEL AND CHLORIDE TRANSPORTER MODULATORS FOR THERAPY IN SMOOTH MUSCLE DISEASES CLCN2, SLC6A1, SLC26A3 IDO1 3703/4885FFAR1 1336/4885GPR84 386/4885

“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.