SCHEMBL8730153

SCHEMBL8730153

COc1ccc(S(=O)(=O)NCC2Cc3ccc(C(CC=O)C(=O)O)cc3C2)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 6/20 0.46
ALDH1A1 P00352 7/20 0.44
GAA P10253 2/20 0.44
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
LMNA P02545 2/20 0.43
PKM P14618 1/20 0.43
POLB P06746 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TSHR P16473 1/20 0.41

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
SCHEMBL8734674 0.89 AKR1C3 (0.49) TBXA2RALDH1A1GAACNR1CNR2
SCHEMBL8730097 0.87 TBXA2R (0.59) TBXA2RLMNAMEN1KMT2A
SCHEMBL8733706 0.85 TBXA2R (0.50) TBXA2RALDH1A1GAACNR1CNR2
SCHEMBL8734682 0.85 ALDH1A1 (0.50) TBXA2RALDH1A1GAACNR1CNR2
SCHEMBL8733775 0.78 TBXA2R (0.57) TBXA2RMEN1KMT2A
SCHEMBL8733707 0.78 TBXA2R (0.53) TBXA2RALDH1A1GAACNR1CNR2
SCHEMBL8982168 0.78 TBXA2R (0.58) TBXA2RALDH1A1PKMPOLBMEN1
SCHEMBL8733551 0.77 TBXA2R (0.61) TBXA2RALDH1A1LMNAMEN1KMT2A
SCHEMBL8730099 0.77 TBXA2R (0.66) TBXA2RMEN1KMT2ATSHR
SCHEMBL8731652 0.77 TBXA2R (0.55) TBXA2RALDH1A1LMNAMEN1KMT2A

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 1 patent. 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 disclosed