SCHEMBL11623656

SCHEMBL11623656

CCSOC(=O)C(C)Oc1ccc(-c2ccc(Cl)cn2)cc1O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
TSHR P16473 2/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
ALDH1A1 P00352 4/20 0.36
LMNA P02545 4/20 0.36
TDP1 Q9NUW8 2/20 0.36
MAPT P10636 2/20 0.36
GRIA2 P42262 1/20 0.35
GAA P10253 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
P2RX7 Q99572 2/20 0.34
KDM4E B2RXH2 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
HTT P42858 1/20 0.34
HPGD P15428 2/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL11623239 0.86 SMN1; SMN2 (0.40) SMN1; SMN2TSHRHTR2AHTR2CHTR2B
SCHEMBL11602755 0.85 GRIA2 (0.41) SMN1; SMN2TSHRHTR2AHTR2CHTR2B
SCHEMBL11626807 0.83 P2RX7 (0.39) SMN1; SMN2TSHRHTR2AHTR2CHTR2B
SCHEMBL10513666 0.82 GRIA2 (0.40) SMN1; SMN2TSHRHTR2AHTR2CHTR2B
SCHEMBL10513431 0.82 TSHR (0.51) SMN1; SMN2TSHRHTR2AHTR2CHTR2B
SCHEMBL11603593 0.82 FPR2 (0.40) SMN1; SMN2TSHRHTR2AHTR2CHTR2B
SCHEMBL11474480 0.78 GRIA2 (0.37) ALDH1A1LMNATDP1MAPTGRIA2
SCHEMBL10771495 0.78 MAPT (0.35) SMN1; SMN2TSHRHTR2AHTR2CHTR2B
SCHEMBL10513001 0.77 GRIA2 (0.36) HTR2CTDP1GRIA2MEN1KMT2A
SCHEMBL10512479 0.76 GRIA2 (0.36) TSHRHTR2AHTR2CHTR2BTDP1

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-4115102-A PYRIDYLOXYPHENOXYALKANE CARBOXYLIC ACIDS ISHIHARA SANGYO KAISHA, LTD. (JP) 1978-09-19 US claimed