SCHEMBL6561148

SCHEMBL6561148

CC1(C)C/C(=N\O)c2cc(C(=O)O)ccc2O1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
ALDH1A1 P00352 13/20 0.44
KDM4E B2RXH2 12/20 0.44
GAA P10253 8/20 0.44
HPGD P15428 4/20 0.44
GLA P06280 4/20 0.44
CASP1 P29466 2/20 0.44
HSD17B10 Q99714 2/20 0.44
CASP7 P55210 1/20 0.44
MAPK1 P28482 1/20 0.40
NPC1 O15118 1/20 0.39
BCL2L1 Q07817 1/20 0.39
TDP1 Q9NUW8 3/20 0.38
RXRA P19793 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
SSTR5 P35346 1/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
POLB P06746 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
SCHEMBL6561151 1.00 MAPT (0.47) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL3353464 0.82 MAPT (0.68) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL6559530 0.80 KDM4E (0.49) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL6559535 0.80 KDM4E (0.49) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL6561063 0.78 MAPT (0.43) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL6561065 0.78 MAPT (0.43) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL6561022 0.78 BCL2L1 (0.43) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL6561017 0.78 BCL2L1 (0.43) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL2812534 0.76 RXRA (0.52) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL6559505 0.76 KDM4E (0.61) MAPTALDH1A1KDM4EGAAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0807629-B1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them AVENTIS PHARMA GMBH (DE) 2004-03-03 EP disclosed
US-6191164-B1 POTASSIUM CHANNEL MODULATORS; ANTIULCER AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 2001-02-20 US disclosed
EP-0807629-A1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1997-11-19 EP disclosed