SCHEMBL7918947

SCHEMBL7918947

CS(=O)(=O)NCCSc1ccc(CC(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.63
MAPT P10636 2/20 0.63
RECQL P46063 1/20 0.46
MTNR1A P48039 1/20 0.42
MTNR1B P49286 1/20 0.42
KMT2A Q03164 1/20 0.42
TSHR P16473 1/20 0.41
TBXA2R P21731 1/20 0.41
MEP1B Q16820 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CASP6 P55212 1/20 0.40
GAA P10253 2/20 0.40
MAPK1 P28482 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
POLB P06746 1/20 0.40
CA2 P00918 1/20 0.40

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
SCHEMBL7921017 0.86 ALDH1A1 (0.60) ALDH1A1MAPTRECQLMTNR1AMTNR1B
SCHEMBL11109419 0.80 TBXA2R (0.60) ALDH1A1MAPTKMT2ATSHRTBXA2R
SCHEMBL9361834 0.79 MEN1 (0.49) ALDH1A1MAPTKMT2ATSHRHSD17B10
SCHEMBL7918974 0.79 ALDH1A1 (0.46) ALDH1A1MAPTTBXA2RHSD17B10HPGD
SCHEMBL7924081 0.79 ALDH1A1 (0.46) ALDH1A1MAPTTBXA2RHSD17B10HPGD
SCHEMBL7911878 0.79 TBXA2R (0.70) ALDH1A1MAPTKMT2ATSHRTBXA2R
SCHEMBL7911851 0.79 ALDH1A1 (0.70) ALDH1A1MAPTKMT2ATSHRTBXA2R
SCHEMBL7911879 0.79 MEP1B (0.53) ALDH1A1MAPTKMT2ATSHRTBXA2R
SCHEMBL7919294 0.79 ALDH1A1 (0.56) ALDH1A1MTNR1AMTNR1BKMT2ATSHR
SCHEMBL5844585 0.77 POLB (0.68) ALDH1A1KMT2ATSHRTBXA2RMEP1B

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