SCHEMBL7409451

SCHEMBL7409451

[CH2]Sc1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
ALDH1A1 P00352 5/20 0.50
TSHR P16473 4/20 0.50
TDP1 Q9NUW8 3/20 0.50
NT5E P21589 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
HSD17B10 Q99714 3/20 0.42
CYP2D6 P10635 2/20 0.42
POLB P06746 1/20 0.42
DNMT1 P26358 1/20 0.39
KDM4E B2RXH2 3/20 0.38
CA2 P00918 4/20 0.35
NAPRT Q6XQN6 1/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA7 P43166 2/20 0.34
CA13 Q8N1Q1 1/20 0.34
HPGD P15428 1/20 0.34
TIMP3 P35625 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL979380 0.80 LMNA (0.56) LMNAALDH1A1TSHRTDP1NT5E
SCHEMBL565078 0.80 LMNA (0.56) LMNAALDH1A1TSHRTDP1NT5E
SCHEMBL518141 0.80 LMNA (0.56) LMNAALDH1A1TSHRTDP1NT5E
SCHEMBL150334 0.79 LMNA (0.77) LMNAALDH1A1TSHRTDP1NT5E
SCHEMBL5590508 0.78 LMNA (0.54) LMNAALDH1A1TSHRTDP1NT5E
Formaldehyde SCHEMBL28763457 0.76 LMNA (0.65) LMNAALDH1A1TSHRTDP1NT5E
Formaldehyde SCHEMBL27960582 0.76 LMNA (0.65) LMNAALDH1A1TSHRTDP1NT5E
SCHEMBL27697112 0.76 LMNA (0.52) LMNAALDH1A1TSHRTDP1NT5E
SCHEMBL28425275 0.76 LMNA (0.52) LMNAALDH1A1TSHRTDP1NT5E
SCHEMBL1892147 0.76 TSHR (0.55) LMNAALDH1A1TSHRTDP1NT5E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4891370-A ELASTASE INHIBITORS MERCK & CO., INC. (US) 1990-01-02 US disclosed
US-4847247-A ELASTASE INHIBITORS MERCK & CO., INC. (US) 1989-07-11 US disclosed
US-4797396-A INHIBITION OF ELASTASE, ANTIBIOTICS MERCK & CO., INC. (US) 1989-01-10 US disclosed
US-4717722-A ELASTASE INHIBITORS MERCK & CO., INC. (US) 1988-01-05 US disclosed
US-4711886-A β-lactam derivatives as anti-inflammatory and antidegenerative agents MERCK & CO., INC. (US) 1987-12-08 US disclosed
US-4623645-A ELASTASE INHIBITORS MERCK & CO., INC. (US) 1986-11-18 US disclosed
EP-0170192-A1 Penicillin derivatives as anti-inflammatory and antidegenerative agents MERCK & CO. INC. (US) 1986-02-05 EP disclosed
US-4547371-A Substituted cephalosporin sulfones as anti-inflammatory and anti-degenerative agents MERCK & CO., INC. (US) 1985-10-15 US disclosed
US-4390693-A BACTERICIDE MERCK & CO., INC. (US) 1983-06-28 US disclosed
US-4386089-A BACTERICIDES, GROWTH PROMOTERS BAYER AKTIENGESELLSCHAFT (DE) 1983-05-31 US disclosed
US-4297488-A 7-α-Methoxy cephalosporins MERCK & CO., INC. (US) 1981-10-27 US disclosed
EP-0004956-B1 BETA-LACTAM ANTIBIOTICS, PROCESS FOR THEIR PREPARATION, FODDER ADDITIVES, DRUGS AND PROCESS FOR THEIR PREPARATION BAYER AG (DE) 1981-10-14 EP disclosed
US-4255423-A BACTERICIDES MERCK & CO., INC. (US) 1981-03-10 US disclosed
EP-0004956-A1 Beta-lactam antibiotics, process for their preparation, fodder additives, drugs and process for their preparation BAYER AG (DE) 1979-10-31 EP disclosed
US-4154845-A ANTIBIOTIC, BACTERICIDE MERCK & CO., INC. (US) 1979-05-15 US disclosed
US-4086423-A CEPHALOSPORINS, CYCLOADDITION OF GLYCINE DERIVATIVE TO THIAZINE COMPOUND MERCK & CO., INC. (US) 1978-04-25 US disclosed
US-4071529-A Derivatives of 6-aminopenicillanic acid MERCK & CO., INC. (US) 1978-01-31 US disclosed
US-4064344-A ANTIBIOTIC MERCK & CO., INC. (US) 1977-12-20 US disclosed
US-4035359-A 6α, β-Substituted penicillin derivatives MERCK & CO., INC. (US) 1977-07-12 US disclosed
US-3974151-A Cephalosporin compounds MERCK & CO., INC. (US) 1976-08-10 US disclosed