SCHEMBL810235

SCHEMBL810235

COc1ccc(S(=O)(=O)NC(c2ccccc2)C(N)c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.54
SLC1A2 P43004 1/20 0.54
SLC1A1 P43005 1/20 0.54
ALDH1A1 P00352 3/20 0.52
POLB P06746 3/20 0.52
CNR1 P21554 1/20 0.52
MMP2 P08253 6/20 0.49
CA12 O43570 2/20 0.49
CA9 Q16790 2/20 0.49
CA14 Q9ULX7 2/20 0.49
PGR P06401 1/20 0.48
MMP9 P14780 4/20 0.47
MMP13 P45452 4/20 0.47
MMP1 P03956 2/20 0.47
MMP8 P22894 2/20 0.47
MMP3 P08254 2/20 0.47
MMP7 P09237 1/20 0.47
KEAP1 Q14145 2/20 0.47
SQSTM1 Q13501 1/20 0.47
NFE2L2 Q16236 1/20 0.47

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
SCHEMBL2240506 1.00 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1ALDH1A1POLB
SCHEMBL2240510 1.00 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1ALDH1A1POLB
SCHEMBL7093075 1.00 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1ALDH1A1POLB
SCHEMBL7093073 1.00 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1ALDH1A1POLB
SCHEMBL7091907 0.99 SLC1A3 (0.53) SLC1A3SLC1A2SLC1A1ALDH1A1POLB
P-Cymene SCHEMBL6740530 0.89 CNR1 (0.51) SLC1A3SLC1A2SLC1A1ALDH1A1POLB
P-Cymene SCHEMBL7513368 0.89 CNR1 (0.51) SLC1A3SLC1A2SLC1A1ALDH1A1POLB
SCHEMBL13566636 0.88 CNR1 (0.57) SLC1A3SLC1A2SLC1A1ALDH1A1CNR1
SCHEMBL12674763 0.88 CNR1 (0.57) SLC1A3SLC1A2SLC1A1ALDH1A1CNR1
SCHEMBL10054196 0.88 CNR1 (0.57) SLC1A3SLC1A2SLC1A1ALDH1A1CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2868659-B1 Method for producing optically active naphthalene compound MITSUBISHI TANABE PHARMA CORP (JP) 2016-05-04 EP claimed
US-9181217-B2 Method for producing optically active naphthalene compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-11-10 US claimed
US-20150152082-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE NAPHTHALENE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-06-04 US claimed
EP-2868659-A1 Method for producing optically active naphthalene compound Mitsubishi Tanabe Pharma Corporation (JP) 2015-05-06 EP claimed
EP-2749558-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE NAPHTHALENE COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2014-07-02 EP claimed
US-20130237708-A1 Optically Active Cyclic Alcohol Compound And Method For Preparing The Same MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-09-12 US claimed
EP-1944291-B1 Optically active cyclic alcohol compound and method for producing same MITSUBISHI TANABE PHARMA CORP (JP) 2012-06-13 EP claimed
US-20100152451-A1 OPTICALLY ACTIVE CYCLIC ALCOHOL COMPOUND AND METHOD FOR PREPARING THE SAME MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-06-17 US claimed
EP-1944291-A1 OPTICALLY ACTIVE CYCLIC ALCOHOL COMPOUND AND METHOD FOR PRODUCING SAME Mitsubishi Tanabe Pharma Corporation (JP) 2008-07-16 EP claimed
EP-0915076-B1 Process for the preparation of trans-(R,R)-actinol HOFFMANN LA ROCHE (CH) 2002-01-16 EP claimed
US-6187961-B1 HYDROGENATING (R)-LEVODIONE IN PRESENCE OF HYDROGEN DONAR AND A SOLVENT OR IN PRESENCE OF HYDROGEN DONOR WHICH SIMULTANEOUSLY USED AS THE SOLVENT, AND AN AMINO-AMIDE-RUTHENIUM COMPLEX ROCHE VITAMINS INC. 2001-02-13 US claimed
CN-1223998-A Process for producing trans- (R, R) -actinol HOFFMANN LA ROCHE (CH) 1999-07-28 CN claimed
EP-0915076-A1 Process for the preparation of trans-(R,R)-actinol F. HOFFMANN-LA ROCHE AG (CH) 1999-05-12 EP claimed
EP-2399895-B1 Process for producing optically active aliphatic fluoroalcohol KANTO KAGAKU (JP) 2018-08-08 EP disclosed
US-9896402-B2 Method for preventing decrease in optical purity TAKASAGO INTERNATIONAL CORPORATION (JP) 2018-02-20 US disclosed
EP-2774908-B1 METHOD FOR PREVENTING DECREASE IN OPTICAL PURITY TAKASAGO PERFUMERY CO LTD (JP) 2017-02-08 EP disclosed
US-6300509-B1 CATALYST FOR DIASTEREOSELECTIVE TRANSFER HYDROGENATION OF (R)-LEVODIONE TO TRANS-(R,R)-ACTINOL IN PRESENCE OF HYDROGEN DONOR, WHICH SIMULTANEOUSLY CAN BE USED AS SOLVENT ROCHE VITAMINS INC. 2001-10-09 US disclosed
US-6187961-B1 HYDROGENATING (R)-LEVODIONE IN PRESENCE OF HYDROGEN DONAR AND A SOLVENT OR IN PRESENCE OF HYDROGEN DONOR WHICH SIMULTANEOUSLY USED AS THE SOLVENT, AND AN AMINO-AMIDE-RUTHENIUM COMPLEX ROCHE VITAMINS INC. 2001-02-13 US disclosed
CN-1223998-A Process for producing trans- (R, R) -actinol HOFFMANN LA ROCHE (CH) 1999-07-28 CN disclosed
EP-0915076-A1 Process for the preparation of trans-(R,R)-actinol F. HOFFMANN-LA ROCHE AG (CH) 1999-05-12 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 (3 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-20150152082-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE NAPHTHALENE COMPOUND HRH1, HRH4, RB1 SLC1A3 4437/4885SLC1A2 4280/4885SLC1A1 4262/4885
US-20100152451-A1 OPTICALLY ACTIVE CYCLIC ALCOHOL COMPOUND AND METHOD FOR PREPARING THE SAME ADH1C, ADH1A, ADH5 SLC1A3 3110/4885SLC1A2 2955/4885SLC1A1 3397/4885
US-20130237708-A1 Optically Active Cyclic Alcohol Compound And Method For Preparing The Same ADH1C, ADH1A, ADH5 SLC1A3 3110/4885SLC1A2 2955/4885SLC1A1 3397/4885

“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.