SCHEMBL8982168

SCHEMBL8982168

CCC(C(=O)O)c1ccc2c(c1)CC(CNS(=O)(=O)c1ccccc1)C2

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 10/20 0.58
GBA1 P04062 1/20 0.48
POLB P06746 1/20 0.47
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 3/20 0.43
PKM P14618 1/20 0.42

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
SCHEMBL8733551 0.90 TBXA2R (0.61) TBXA2RMEN1KMT2AALDH1A1
SCHEMBL8734674 0.89 AKR1C3 (0.49) TBXA2RMEN1KMT2AALDH1A1PKM
SCHEMBL8730079 0.85 TBXA2R (0.61) TBXA2RGBA1POLBMEN1KMT2A
SCHEMBL8733698 0.82 TBXA2R (0.59) TBXA2RMEN1KMT2AALDH1A1
SCHEMBL8982158 0.81 TBXA2R (0.57) TBXA2RGBA1POLBALDH1A1
SCHEMBL8731665 0.81 TBXA2R (0.57) TBXA2RMEN1KMT2AALDH1A1
SCHEMBL8733700 0.81 TBXA2R (0.62) TBXA2RMEN1KMT2A
SCHEMBL8730097 0.78 TBXA2R (0.59) TBXA2RMEN1KMT2A
SCHEMBL8730153 0.78 TBXA2R (0.46) TBXA2RPOLBMEN1KMT2AALDH1A1
SCHEMBL8982185 0.77 TBXA2R (0.58) TBXA2RMEN1KMT2AALDH1A1

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-0589037-B1 INDIAN DERIVATIVE AND THROMBOXANE ANTAGONIST CONTAINING THE SAME ZERIA PHARM CO LTD (JP) 1996-05-29 EP disclosed
US-5409956-A A sulfonylaminoalkylindan carboxylic acid or ester for treating thrombosis, vasospasm or asthma ZERIA PHARMACEUTICAL CO., LTD. (JP) 1995-04-25 US disclosed
EP-0589037-A1 INDIAN DERIVATIVE AND THROMBOXANE ANTAGONIST CONTAINING THE SAME ZERIA PHARMACEUTICAL CO., LTD. (JP) 1994-03-30 EP disclosed