SCHEMBL8731672

SCHEMBL8731672

CC(=O)Oc1ccc2c(c1)CC(CNS(=O)(=O)c1ccccc1)C2

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 10/20 0.61
GBA1 P04062 1/20 0.51
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NPY1R P25929 1/20 0.45
NPY5R Q15761 1/20 0.45
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PKM P14618 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
POLB P06746 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
SCHEMBL8734692 0.89 KMT2A (0.52) TBXA2RKDM4ELMNAALDH1A1MEN1
SCHEMBL8734679 0.89 TBXA2R (0.67) TBXA2RLMNANPY1RNPY5RALDH1A1
SCHEMBL8734192 0.88 TBXA2R (0.49) TBXA2RGBA1NPY1RNPY5RALDH1A1
Water SCHEMBL2762310 0.86 TBXA2R (0.63) TBXA2RALDH1A1SMN1; SMN2PKMMEN1
SCHEMBL8728445 0.86 TBXA2R (0.57) TBXA2RGBA1NPY1RNPY5RALDH1A1
SCHEMBL8728399 0.86 TBXA2R (0.48) TBXA2RKDM4EALDH1A1SMN1; SMN2PKM
SCHEMBL8734707 0.84 TBXA2R (0.64) TBXA2RLMNANPY5RALDH1A1SMN1; SMN2
SCHEMBL8734665 0.84 TBXA2R (0.66) TBXA2RTDP1NPY1RNPY5RALDH1A1
SCHEMBL8730030 0.83 TBXA2R (0.61) TBXA2RGBA1NPY1RNPY5R
SCHEMBL8733559 0.82 TBXA2R (0.54) TBXA2RLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5750524-A ADMINISTERING AN SULFAMIDE SUBSTITUTED INDAN DERIVATIVE ZERIA PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US claimed
US-5750524-A ADMINISTERING AN SULFAMIDE SUBSTITUTED INDAN DERIVATIVE ZERIA PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US disclosed