SCHEMBL27735019

SCHEMBL27735019

C=CC(N1CCOCC1)S(=O)(=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.45
TSHR P16473 1/20 0.45
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
KDM4E B2RXH2 1/20 0.41
POLB P06746 2/20 0.41
GAA P10253 1/20 0.41
ALDH1A1 P00352 4/20 0.40
LMNA P02545 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
RAB9A P51151 1/20 0.40
HSD17B10 Q99714 2/20 0.39
HTT P42858 2/20 0.39
PIK3CA P42336 1/20 0.38
GRM5 P41594 1/20 0.37
KCNA5 P22460 1/20 0.37

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
SCHEMBL27754807 0.96 TSHR (0.42) PKMTSHRKMT2AMEN1KDM4E
SCHEMBL27693489 0.85 POLB (0.36) PKMTSHRKMT2AMEN1KDM4E
SCHEMBL27831737 0.85 MEN1 (0.37) PKMTSHRKMT2AMEN1KDM4E
SCHEMBL27726282 0.85 MAPT (0.41) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL27642279 0.84 ALDH1A1 (0.41) TSHRKDM4EPOLBGAAALDH1A1
SCHEMBL27675176 0.84 TSHR (0.42) PKMTSHRPOLBALDH1A1LMNA
SCHEMBL27743079 0.84 PKM (0.41) PKMKMT2AMEN1ALDH1A1LMNA
SCHEMBL27989710 0.82 L3MBTL1 (0.39) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL27788104 0.82 CHRM2 (0.50) TSHRKDM4EPOLBSMN1; SMN2
SCHEMBL27448396 0.82 ALDH1A1 (0.36) TSHRKMT2AMEN1KDM4EPOLB

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
CN-101305001-A Indolizine derivatives as ligands of the CRTH2 receptor ARGENTA DISCOVERY LTD (GB) 2008-11-12 CN disclosed
CN-101243086-A Indolizine derivatives and their use as CRTH2 antagonists ARGENTA DISCOVERY LTD (GB) 2008-08-13 CN disclosed