SCHEMBL8469671

SCHEMBL8469671

COc1ccc(C(O)S(=O)(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.47
CA2 P00918 4/20 0.47
ACHE P22303 1/20 0.47
PKM P14618 2/20 0.47
AOC3 Q16853 2/20 0.44
ACP3 P15309 1/20 0.44
MMP1 P03956 2/20 0.44
MMP13 P45452 2/20 0.44
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP8 P22894 1/20 0.44
GAA P10253 1/20 0.44
CA9 Q16790 2/20 0.44
CA12 O43570 1/20 0.44
CA7 P43166 1/20 0.44
CA14 Q9ULX7 1/20 0.44
ALDH1A1 P00352 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL14355500 0.82 ALDH1A1 (0.43) CA1CA2CA9CA12CA14
SCHEMBL27622144 0.80 CA1 (0.51) CA1CA2ACHEPKMACP3
Sulfuric Acid SCHEMBL22498737 0.80 CA1 (0.51) CA1CA2ACHEPKMAOC3
SCHEMBL27763142 0.78 CA1 (0.46) CA1CA2ACHEPKMAOC3
SCHEMBL2388659 0.78 CA1 (0.50) CA1CA2ACHEPKMAOC3
SCHEMBL11218212 0.78 ALOX5 (0.49) CA1CA2ACHEPKMMMP13
SCHEMBL14355490 0.78 L3MBTL1 (0.53) AOC3ALDH1A1TSHRMAPK1L3MBTL1
SCHEMBL18608218 0.77 ACACB (0.47) CA1CA2CA9CA12ALDH1A1
SCHEMBL10404138 0.76 CA1 (0.44) CA1CA2ACHEPKMACP3
SCHEMBL10402675 0.76 CA1 (0.44) CA1CA2ACHEPKMACP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0956282-A1 SULPHINIC ACID DERIVATIVES, METHOD FOR PRODUCING THEM, AND THEIR USE L. Brüggemann KG (DE) 1999-11-17 EP claimed
WO-1999018067-A1 SULPHINIC ACID DERIVATIVES, METHOD FOR PRODUCING THEM, AND THEIR USE L. Brüggemann KG (DE) 1999-04-15 WO claimed
US-20120283433-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES MANI NEELAKANDHA S (US) 2012-11-08 US disclosed
US-20120029191-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES MANI NEELAKANDHA S (US) 2012-02-02 US disclosed
US-8063206-B2 Processes for the preparation of cyclopropyl-amide derivatives JANSSEN PHARMACEUTICA NV (BE) 2011-11-22 US disclosed
US-20100286391-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2010-11-11 US disclosed
US-7795426-B2 Processes for the preparation of cyclopropyl-amide derivatives JANSSEN PHARMACEUTICA NV (BE) 2010-09-14 US disclosed
US-20100197689-A1 NOVEL PROCESSES FOR THE PREPARATION OF PIPERAZINYL AND DIAZAPANYL BENZAMIDE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2010-08-05 US disclosed
US-7728129-B2 Processes for the preparation of piperazinyl and diazapanyl benzamide derivatives JANSSEN PHARMACEUTICA NV (BE) 2010-06-01 US disclosed
US-7300501-B2 Electroless gold plating liquid NIKKO MATERIALS CO., LTD. (JP) 2007-11-27 US disclosed
US-7300501-B2 Electroless gold plating liquid NIKKO MATERIALS CO., LTD. (JP) 2007-11-27 US disclosed
US-20070197508-A1 NOVEL PROCESSES FOR THE PREPARATION OF PIPERAZINYL AND DIAZAPANYL BENZAMIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2007-08-23 US disclosed
US-20070197508-A1 NOVEL PROCESSES FOR THE PREPARATION OF PIPERAZINYL AND DIAZAPANYL BENZAMIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2007-08-23 US disclosed
US-20070129351-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2007-06-07 US disclosed
US-20070129351-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2007-06-07 US disclosed
WO-2007053386-A2 PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-10 WO disclosed
WO-2007053427-A2 NOVEL PROCESSES FOR THE PREPARATION OF PIPERAZINYL AND DIAZAPANYL BENZAMIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-10 WO disclosed
US-20070095249-A1 Electroless gold plating liquid JX NIPPON MINING & METALS CORPORATION (JP) 2007-05-03 US disclosed
US-20070095249-A1 Electroless gold plating liquid JX NIPPON MINING & METALS CORPORATION (JP) 2007-05-03 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 (6 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-20100286391-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES HRH4, HRH2, HRH1 CA1 1662/4885CA2 1679/4885ACHE 903/4885
US-20070197508-A1 NOVEL PROCESSES FOR THE PREPARATION OF PIPERAZINYL AND DIAZAPANYL BENZAMIDE DERIVATIVES HRH2, HRH4, HRH1 CA1 2497/4885CA2 1016/4885ACHE 758/4885
US-20100197689-A1 NOVEL PROCESSES FOR THE PREPARATION OF PIPERAZINYL AND DIAZAPANYL BENZAMIDE DERIVATIVES HRH2, HRH4, HRH1 CA1 2497/4885CA2 1016/4885ACHE 758/4885
US-20070129351-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES HRH4, HRH2, HRH1 CA1 1662/4885CA2 1679/4885ACHE 903/4885
US-20120283433-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES HRH4, HRH2, HRH1 CA1 1662/4885CA2 1679/4885ACHE 903/4885
US-20120029191-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES HRH4, HRH2, HRH1 CA1 1662/4885CA2 1679/4885ACHE 903/4885

“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.