SCHEMBL9834810

SCHEMBL9834810

O=C1CCCC(CNS(=O)(=O)c2ccccc2)C1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.65
ALDH1A1 P00352 5/20 0.55
PKM P14618 1/20 0.55
KMT2A Q03164 5/20 0.50
CTSL P07711 3/20 0.50
CTSK P43235 3/20 0.50
CTSB P07858 2/20 0.50
PARG Q86W56 1/20 0.47
MEN1 O00255 3/20 0.46
POLB P06746 2/20 0.45
TBXA2R P21731 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
KEAP1 Q14145 1/20 0.45
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL9834420 0.91 GBA1 (0.69) GBA1ALDH1A1PKMKMT2ACTSL
SCHEMBL9833735 0.86 KMT2A (0.55) GBA1ALDH1A1KMT2AMEN1
SCHEMBL9832410 0.86 CNR1 (0.48) GBA1ALDH1A1PKMKMT2AMEN1
SCHEMBL9834257 0.86 SMN1; SMN2 (0.50) GBA1ALDH1A1PKMKMT2AMEN1
SCHEMBL3811045 0.83 GBA1 (0.86) GBA1ALDH1A1PKMKMT2ACTSL
SCHEMBL8394068 0.83 GBA1 (0.86) GBA1ALDH1A1PKMKMT2ACTSL
SCHEMBL9834675 0.82 GBA1 (0.78) GBA1ALDH1A1PKMKMT2ACTSL
SCHEMBL7886816 0.82 GBA1 (0.83) GBA1ALDH1A1PKMKMT2ACTSL
SCHEMBL8396377 0.82 GBA1 (0.83) GBA1ALDH1A1PKMKMT2ACTSL
SCHEMBL2470122 0.80 GBA1 (1.00) GBA1ALDH1A1PKMKMT2ACTSL

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-0242518-B1 Cycloalkano[1,2-b]indole-sulfonamides BAYER AG (DE) 1991-04-10 EP disclosed
US-4988820-A Inhibiting platelet aggregation, anticoagulants, thromboxane a2 antagonist BAYER AKTIENGESELLSCHAFT (DE) 1991-01-29 US disclosed
US-4965258-A Anticoagulant; thromboxane a2 antagonist BAYER AKTIENGESELLSCHAFT (DE) 1990-10-23 US disclosed
US-4904797-A REACTING A (BENZENESULFONAMIDOALKYL)CYCLOALKANO(1,2-B)INDOLE WITH ACRYLONITRILE; HYDROLYSIS, HYDROGENATION, REDUCTION BAYER AKTIENGESELLSCHAFT (DE) 1990-02-27 US disclosed
US-4827032-A INTERMEDIATES FOR ANTICOAGULANTS BAYER AKTIENGESELLSCHAFT (DE) 1989-05-02 US disclosed
EP-0242518-A1 Cycloalkano[1,2-b]indole-sulfonamides BAYER AG (DE) 1987-10-28 EP disclosed