SCHEMBL9375035

SCHEMBL9375035

O=C(Cl)c1sc2ccc(Oc3ccccc3)cc2c1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.48
PRSS12 P56730 3/20 0.46
NPSR1 Q6W5P4 2/20 0.44
RXFP1 Q9HBX9 2/20 0.44
PRNP P04156 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
PPARG P37231 1/20 0.44
HTT P42858 1/20 0.44
MAPK10 P53779 1/20 0.44
NCOA2 Q15596 1/20 0.44
MAPT P10636 4/20 0.43
DYRK1A Q13627 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PTPN7 P35236 1/20 0.42
DUSP3 P51452 1/20 0.42
PTPN12 Q05209 1/20 0.42
PTPN22 Q9Y2R2 1/20 0.42
ALDH1A1 P00352 3/20 0.41
THRB P10828 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
SCHEMBL9371630 0.89 RXFP1 (0.53) MCL1PRSS12NPSR1RXFP1PRNP
SCHEMBL1447569 0.84 PRNP (0.60) PRSS12NPSR1RXFP1PRNPTSHR
SCHEMBL9372198 0.82 EDNRA (0.61) MCL1MAPTDYRK1AALDH1A1EDNRA
SCHEMBL3050845 0.80 HTT (0.46) MCL1NPSR1RXFP1PRNPTSHR
SCHEMBL5102909 0.78 EDNRA (0.43) RXFP1PRNPMAPTPTPN7DUSP3
SCHEMBL5211159 0.77 NPSR1 (0.52) MCL1PRSS12NPSR1RXFP1PRNP
SCHEMBL1255148 0.76 BCKDK (0.58) MCL1RXFP1TSHRMAPTSMN1; SMN2
SCHEMBL8877598 0.76 MCL1 (0.56) MCL1NPSR1RXFP1PRNPTSHR
SCHEMBL64428 0.75 MCL1 (0.73) MCL1RXFP1PRNPHTTMAPT
SCHEMBL3155578 0.75 LTA4H (0.50) TSHRHTTMAPTSMN1; SMN2PTPN7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0299457-B1 Novel benzothiophenes having antiallergic activity and both novel and other selected benzothiophenes having activity for treating acute respiratory distress syndrome WARNER LAMBERT CO (US) 1994-09-21 EP disclosed
US-4931459-A ADMINISTERING SUBSTITUTED BENZOTHIOPHENES OR BENZOFURANS WARNER-LAMBERT COMPANY (US) 1990-06-05 US disclosed
US-4910317-A Containing a 5-amidetetrazole substitution in position 2 WARNER-LAMBERT COMPANY (US) 1990-03-20 US disclosed
EP-0299457-A2 Novel benzothiophenes having antiallergic activity and both novel and other selected benzothiophenes having activity for treating acute respiratory distress syndrome WARNER-LAMBERT COMPANY (US) 1989-01-18 EP disclosed