SCHEMBL9311344

SCHEMBL9311344

CCOC(=O)COc1ccc(CC(NS(=O)(=O)c2ccccc2)c2cccnc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 5/20 0.47
POLB P06746 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
GAA P10253 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ADAMTS4 O75173 1/20 0.44
PKM P14618 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 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
SCHEMBL9310918 0.94 TSHR (0.61) TSHRSMN1; SMN2ALDH1A1POLBMEN1
SCHEMBL9313041 0.91 TSHR (0.65) TSHRSMN1; SMN2ALDH1A1POLBMEN1
SCHEMBL9311525 0.84 TSHR (0.57) TSHRSMN1; SMN2ALDH1A1POLBGAA
SCHEMBL9311010 0.82 TSHR (0.52) TSHRSMN1; SMN2ALDH1A1POLBGAA
SCHEMBL9311342 0.81 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1POLBMEN1KMT2A
SCHEMBL9765259 0.80 GAA (0.53) TSHRSMN1; SMN2ALDH1A1POLBMEN1
SCHEMBL9311671 0.79 TBXAS1 (0.50) SMN1; SMN2
SCHEMBL9311656 0.78 TSHR (0.53) TSHRSMN1; SMN2ALDH1A1KMT2AGAA
SCHEMBL9312306 0.78 TSHR (0.59) TSHRSMN1; SMN2ALDH1A1POLBGAA
SCHEMBL9312705 0.78 TBXAS1 (0.44) SMN1; SMN2ALDH1A1POLBMEN1KMT2A

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-5374641-A Thromboxane synthetase inhibitors, prostaglandin H2 antagonist , anticoagulants and antiallergens TERUMO KABUSHIKI KAISHA (JP) 1994-12-20 US disclosed
EP-0501876-A1 N-(3-pyridylalkyl)sulfonamide derivative and pharmaceutical preparation containing thereof TERUMO KABUSHIKI KAISHA (JP) 1992-09-02 EP disclosed