SCHEMBL7918951

SCHEMBL7918951

CCOC(=O)COc1ccc(CCSCCCNS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 1/20 0.57
TBXAS1 P24557 1/20 0.57
TSHR P16473 4/20 0.56
ALDH1A1 P00352 3/20 0.56
TP53 P04637 1/20 0.56
ALOX15 P16050 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.52
SGMS1 Q86VZ5 6/20 0.50
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
HTT P42858 1/20 0.48
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
NPSR1 Q6W5P4 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
SCHEMBL7918882 0.94 TBXA2R (0.59) TBXA2RTBXAS1TSHRALDH1A1TP53
SCHEMBL11379516 0.88 TBXA2R (0.74) TBXA2RTBXAS1TSHRALDH1A1TP53
SCHEMBL7921088 0.85 ALDH1A1 (0.63) TBXA2RTBXAS1TSHRALDH1A1TP53
SCHEMBL8440203 0.82 TSHR (0.52) TBXA2RTBXAS1TSHRALDH1A1TP53
SCHEMBL11363199 0.81 TSHR (0.75) TBXA2RTBXAS1TSHRALDH1A1TP53
SCHEMBL7924015 0.81 ALDH1A1 (0.68) TBXA2RTBXAS1TSHRALDH1A1TP53
SCHEMBL8441528 0.79 TSHR (0.49) TBXA2RTBXAS1TSHRALDH1A1TP53
SCHEMBL11372605 0.79 ALDH1A1 (0.67) TBXA2RTBXAS1TSHRALDH1A1TP53
SCHEMBL7920983 0.79 TBXA2R (0.63) TBXA2RTBXAS1ALDH1A1SGMS1HTT
SCHEMBL11379124 0.78 ALDH1A1 (0.68) TBXA2RTBXAS1TSHRALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0811375-B1 GLUTAMIC ACID RECEPTOR AGONIST NIPPON SUISAN KAISHA LTD (JP) 2001-01-03 EP disclosed
US-5955505-A TREATING NERVE DEGENERATIVE DISORDERS NIPPON SUISAN KAISHA, LTD. (JP) 1999-09-21 US disclosed
EP-0811375-A1 GLUTAMIC ACID RECEPTOR AGONIST NIPPON SUISAN KAISHA, LTD. (JP) 1997-12-10 EP disclosed
EP-0469901-B1 Sulfonamide derivatives TAISHO PHARMACEUTICAL CO LTD (JP) 1994-10-19 EP disclosed
US-5189211-A Thromboxane A2 antagonists TAISHO PHARMACEUTICAL CO., LTD. (JP) 1993-02-23 US disclosed
EP-0469901-A1 Sulfonamide derivatives TAISHO PHARMACEUTICAL CO. LTD (JP) 1992-02-05 EP disclosed