SCHEMBL7508734

SCHEMBL7508734

O=S1(=O)c2sccc2C(O)CN1CCN1CCOCC1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
KMT2A Q03164 6/20 0.37
LMNA P02545 4/20 0.37
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
ALDH1A1 P00352 5/20 0.34
MAPT P10636 4/20 0.34
HTT P42858 1/20 0.34
CYP2C19 P33261 2/20 0.33
HRH3 Q9Y5N1 1/20 0.33
CASR P41180 1/20 0.32
ALOX15 P16050 1/20 0.32
MAPK1 P28482 1/20 0.32
MPI P34949 1/20 0.32
TSHR P16473 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL7508801 0.78 CA2 (0.39) LMNAGAAALDH1A1
SCHEMBL3585070 0.76 CA2 (0.47) LMNAGAAALDH1A1MAPT
SCHEMBL3577810 0.76 CA2 (0.47) LMNAGAAALDH1A1MAPT
SCHEMBL7512761 0.75 CA2 (0.52) LMNA
SCHEMBL9596744 0.75 KMT2A (0.37) L3MBTL1KMT2ALMNAGLAGAA
SCHEMBL7515709 0.74
Hydrochloric Acid SCHEMBL7509372 0.74 CA2 (0.51) LMNA
SCHEMBL8950462 0.74 CA2 (0.37) L3MBTL1LMNAGAAALDH1A1CYP2C19
SCHEMBL7504951 0.72 GBA1 (0.35) KMT2AALDH1A1
SCHEMBL8950469 0.68 KMT2A (0.39) L3MBTL1KMT2ALMNAGLAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0527801-B1 THIOPHENE SULFONAMIDES USEFUL AS CARBONIC ANHYDRASE INHIBITORS ALCON LAB INC (US) 2002-07-31 EP disclosed
US-5240923-A Treating glaucoma ALCON LABORATORIES, INC. (US) 1993-08-31 US disclosed
US-5153192-A For controlling intraocular pressure ALCON LABORATORIES, INC. (US) 1992-10-06 US disclosed