SCHEMBL7921088

SCHEMBL7921088

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

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.63
HTT P42858 1/20 0.63
MEN1 O00255 1/20 0.57
MAPT P10636 1/20 0.57
KMT2A Q03164 1/20 0.57
TSHR P16473 4/20 0.56
TP53 P04637 1/20 0.56
ALOX15 P16050 1/20 0.56
TBXA2R P21731 1/20 0.55
TBXAS1 P24557 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.54
GAA P10253 2/20 0.54
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
POLB P06746 1/20 0.50
NPSR1 Q6W5P4 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
SCHEMBL7918882 0.91 TBXA2R (0.59) ALDH1A1HTTTSHRTP53ALOX15
SCHEMBL7921101 0.90 ALDH1A1 (0.57) ALDH1A1HTTMEN1MAPTKMT2A
SCHEMBL11379516 0.86 TBXA2R (0.74) ALDH1A1HTTTSHRTP53ALOX15
SCHEMBL7924015 0.85 ALDH1A1 (0.68) ALDH1A1MAPTTSHRTP53ALOX15
SCHEMBL7918951 0.85 TBXA2R (0.57) ALDH1A1HTTTSHRTP53ALOX15
SCHEMBL7920565 0.84 ALDH1A1 (0.60) ALDH1A1HTTMEN1MAPTKMT2A
SCHEMBL11363199 0.83 TSHR (0.75) ALDH1A1HTTTSHRTP53ALOX15
SCHEMBL7924006 0.81 SMN1; SMN2 (0.61) ALDH1A1HTTMEN1KMT2ATSHR
SCHEMBL8440203 0.78 TSHR (0.52) ALDH1A1KMT2ATSHRTP53ALOX15
SCHEMBL7924019 0.78 TBXA2R (0.58) ALDH1A1HTTMEN1MAPTKMT2A

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