SCHEMBL6401690

SCHEMBL6401690

O=C(S)c1cc(Cl)ccc1O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.67
CA2 P00918 1/20 0.67
P2RX1 P51575 6/20 0.55
KCNMA1 Q12791 2/20 0.55
TMPRSS4 Q9NRS4 3/20 0.53
P2RX4 Q99571 3/20 0.53
P2RX7 Q99572 3/20 0.53
MAPT P10636 2/20 0.50
HSD17B10 Q99714 2/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
USP2 O75604 1/20 0.50
LMNA P02545 1/20 0.50
TP53 P04637 1/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50
MAPK1 P28482 1/20 0.50
HTT P42858 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL2956454 0.83 CA1 (0.50) CA1CA2P2RX1KCNMA1TMPRSS4
SCHEMBL6966672 0.82 CA1 (0.72) CA1CA2P2RX1KCNMA1TMPRSS4
SCHEMBL9586276 0.80 ALDH1A1 (0.65) CA1CA2MAPTHSD17B10LMNA
5-Chlorosalicylic Acid SCHEMBL130605 0.80 CA1 (1.00) CA1CA2P2RX1KCNMA1TMPRSS4
SCHEMBL4955043 0.80 CA1 (0.69) CA1CA2P2RX1KCNMA1TMPRSS4
SCHEMBL29769239 0.80 CA1 (0.69) CA1CA2P2RX1KCNMA1TMPRSS4
5-Chlorosalicylic Acid SCHEMBL29499764 0.80 CA1 (1.00) CA1CA2P2RX1KCNMA1TMPRSS4
SCHEMBL6153483 0.78 CA1 (0.67) CA1CA2P2RX1KCNMA1TMPRSS4
SCHEMBL218964 0.78 CA1 (0.67) CA1CA2P2RX1KCNMA1TMPRSS4
5-Chlorosalicylic Acid SCHEMBL6855770 0.78 CA1 (0.96) CA1CA2P2RX1KCNMA1TMPRSS4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10399986-B2 Inhibitors of leukotriene A4 hydrolase CELTAXSYS, INC. (US) 2019-09-03 US disclosed
US-20180127424-A1 INHIBITORS OF LEUKOTRIENE A4 HYDROLASE CELLTAXIS, LLC 2018-05-10 US disclosed
US-20050119237-A1 Non-malignant disease treatment with Ras antagonists RAMOT UNIVERSITY AUTHORITY FOR APPLIED RESEARCH & INDUSTRIAL DEVELOPMENT LTD. (IL) 2005-06-02 US disclosed
EP-1187605-A4 NON-MALIGNANT DISEASE TREATMENT WITH RAS ANTAGONISTS THYREOS CORP (US) 2004-05-26 EP disclosed
US-6462086-B1 SUCH AS FARNESYLTHIOSALICYLIC ACID; INHIBITING PROLIFERATION OF T-CELLS; DIABETES, LUPUS, MULTIPLE SCLEROSIS; GRAFT REJECTION INDUCED BY FOREIGN ANTIGENS; CIRRHOSIS, RESTENOSIS RAMOT UNIVERSITY AUTHORITY FOR APPLIED RESEARCH AND INDUSTRIAL DEVELOPMENT LTD. (IL) 2002-10-08 US disclosed
EP-1187605-A1 NON-MALIGNANT DISEASE TREATMENT WITH RAS ANTAGONISTS Thyreos Corporation (US) 2002-03-20 EP disclosed
WO-2000078303-A1 NON-MALIGNANT DISEASE TREATMENT WITH RAS ANTAGONISTS THYREOS CORPORATION (US) 2000-12-28 WO disclosed
US-5766556-A SUITABLE ENVIRONMENT FOR SIMULTANEOUS SYNTHESIS OF ORGANIC COMPOUNDS, INORGANIC COMPOUNDS AND ORGANOMETALLIC COMPOUNDS WARNER-LAMBERT COMPANY (US) 1998-06-16 US disclosed
US-5714127-A RESERVOIR RACKS WITH REACTION WELLS; GAS DISPERSION TUBES CONTAINING FILTERS; HOLDER BLOCK WITH APERTURES; MANIFOLD WARNER-LAMBERT COMPANY (US) 1998-02-03 US disclosed
US-5702672-A REACTION TUBE COMPRISING GAS DISPERSION TUBE HAVING GROUNG GLASS JOINT SECTION WARNER-LAMBERT COMPANY (US) 1997-12-30 US disclosed
WO-1996030393-A1 A METHOD FOR THE SYNTHESIS OF MIXTURES OF COMPOUNDS WARNER-LAMBERT COMPANY (US) 1996-10-03 WO disclosed
EP-0663856-A1 APPARATUS AND METHOD FOR MULTIPLE SIMULTANEOUS SYNTHESIS WARNER-LAMBERT COMPANY (US) 1995-07-26 EP disclosed
WO-1994008711-A1 APPARATUS AND METHOD FOR MULTIPLE SIMULTANEOUS SYNTHESIS WARNER-LAMBERT COMPANY (US) 1994-04-28 WO disclosed
CN-1007153-B PREPN. OF BENZOTHIOPHENES AND BENZOFURANS HAVING ANTIALLERGY ACTIVITY WARNER LAMBERT CO (US) 1990-03-14 CN disclosed
US-4663344-A ANTIPYRETICS, ANTIARTHRITIC AGENTS MERCK & CO., INC. (US) 1987-05-05 US disclosed
CN-85109587-A Have the new benzothiophene kind of antiallergic activity and the preparation method of benzofuran compounds 1986-12-17 CN disclosed
EP-0187487-A1 Benzothiophenes and benzofurans having antiallergic activity WARNER-LAMBERT COMPANY (US) 1986-07-16 EP disclosed
EP-0026000-B1 SPIRO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Takeda Chemical Industries, Ltd. (JP) 1983-05-11 EP disclosed
EP-0026000-A1 Spiro compounds, process for their preparation and pharmaceutical compositions containing them Takeda Chemical Industries, Ltd. (JP) 1981-04-01 EP disclosed
US-3953595-A Substituted benzoic acid hypolipemic agents PFIZER INC. (US) 1976-04-27 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 (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-20050119237-A1 Non-malignant disease treatment with Ras antagonists RSU1, KSR1, KRAS CA1 3526/4885CA2 4378/4885P2RX1 4669/4885
US-10399986-B2 Inhibitors of leukotriene A4 hydrolase LTA4H, LTC4S, LTB4R CA1 2810/4885CA2 3422/4885P2RX1 861/4885
US-20180127424-A1 INHIBITORS OF LEUKOTRIENE A4 HYDROLASE LTA4H, LTC4S, LTB4R CA1 2810/4885CA2 3422/4885P2RX1 861/4885

“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.