SCHEMBL8320868

SCHEMBL8320868

N#Cc1cc2c(cc1Cl)OC(C(O)S(=O)(=O)C(F)(F)F)C2

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.33
AR P10275 5/20 0.32
SLC22A12 Q96S37 4/20 0.31
KDM4E B2RXH2 2/20 0.31
GAA P10253 1/20 0.31
RORC P51449 1/20 0.30
TNKS O95271 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30

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
SCHEMBL8459513 0.78 AR (0.36) AR
SCHEMBL7636053 0.73 PGR (0.35) PGRSLC22A12RORC
SCHEMBL7632414 0.67 GAA (0.35) ARKDM4EGAA
SCHEMBL7628632 0.57 MTNR1A (0.38) PGR
SCHEMBL11697440 0.57 SMN1; SMN2 (0.37) KDM4EGAA
SCHEMBL2473598 0.56 SLC22A12 (0.41) PGRARSLC22A12
SCHEMBL10979117 0.55 MAPT (0.47) KDM4EGAA
SCHEMBL145418 0.55 TRPV4 (0.54) ARSLC22A12
SCHEMBL23792337 0.54 PGR (0.38) PGRKDM4E
SCHEMBL8069814 0.54 KDM4E (0.37) ARKDM4EGAA

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
EP-0888327-A1 BENZOPYRAN DERIVATIVES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1999-01-07 EP disclosed
WO-1997034885-A1 BENZOPYRAN DERIVATIVES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1997-09-25 WO disclosed