SCHEMBL7093075

SCHEMBL7093075

COc1ccc(S(=O)(=O)N[C@@H](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
SCHEMBL810235 1.00 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1ALDH1A1POLB
SCHEMBL2240506 1.00 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1ALDH1A1POLB
SCHEMBL2240510 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 13 patents. 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
EP-2868659-B1 Method for producing optically active naphthalene compound MITSUBISHI TANABE PHARMA CORP (JP) 2016-05-04 EP disclosed
US-9181217-B2 Method for producing optically active naphthalene compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-11-10 US disclosed
US-20150152082-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE NAPHTHALENE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-06-04 US disclosed
EP-2868659-A1 Method for producing optically active naphthalene compound Mitsubishi Tanabe Pharma Corporation (JP) 2015-05-06 EP disclosed
EP-2749558-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE NAPHTHALENE COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2014-07-02 EP disclosed
US-20030225289-A1 Process for the preparation of tricyclic amino alcohol derivatives ASAHI KASEI KABUSHIKI KAISHA (JP) 2003-12-04 US disclosed
EP-1209150-A1 PROCESSES FOR THE PREPARATION OF TRICYCLIC AMINO ALCOHOL DERIVATIVES Asahi Kasei Kabushiki Kaisha (JP) 2002-05-29 EP disclosed
EP-1174426-A1 METHOD FOR THE PREPARATION OF TRICYCLIC AMINO ALCOHOL DERIVATIVES THROUGH AZIDES Asahi Kasei Kabushiki Kaisha (JP) 2002-01-23 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 (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-20150152082-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE NAPHTHALENE COMPOUND HRH1, HRH4, RB1 SLC1A3 4437/4885SLC1A2 4280/4885SLC1A1 4262/4885
US-20030225289-A1 Process for the preparation of tricyclic amino alcohol derivatives ADH1A, ADH1C, OXER1 SLC1A3 520/4885SLC1A2 593/4885SLC1A1 584/4885

“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.