SCHEMBL6694748

SCHEMBL6694748

COC(=O)c1cccc2c1c1c(O)cc(C(C)C)cc1n2Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
THRB P10828 1/20 0.43
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
PKM P14618 1/20 0.42
YWHAH Q04917 3/20 0.41
PLA2G2A P14555 5/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
KDM4E B2RXH2 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
AR P10275 1/20 0.38

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
SCHEMBL6890656 0.93 THRB (0.37) MAPTTHRBALDH1A1GAAPKM
SCHEMBL6894722 0.93 PLA2G2A (0.41) MAPTTHRBALDH1A1GAAPKM
SCHEMBL6895778 0.92 PLA2G2A (0.45) MAPTALDH1A1PLA2G2A
SCHEMBL6892310 0.92 FAAH (0.41) MAPTTHRBALDH1A1YWHAH
SCHEMBL6896161 0.91 HSP90AA1 (0.40) MAPTTHRBALDH1A1GAAPKM
SCHEMBL6895041 0.91 MAPT (0.45) MAPTTHRBALDH1A1GAAKMT2A
SCHEMBL27562999 0.91 KDM4E (0.39) MAPTTHRBALDH1A1GAAKMT2A
SCHEMBL6895034 0.90 L3MBTL1 (0.43) MAPTALDH1A1GAAKMT2AMEN1
SCHEMBL6897629 0.90 POLB (0.36) MAPTTHRB
SCHEMBL6893995 0.90 SLC6A2 (0.38) THRBALDH1A1KMT2AMEN1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0952149-A2 Substituted carbazoles, process for their preparation and their use as sPLA2 inhibitiors ELI LILLY AND COMPANY (US) 1999-10-27 EP claimed
EP-0952149-B1 Substituted carbazoles, process for their preparation and their use as sPLA2 inhibitiors LILLY CO ELI (US) 2004-06-09 EP disclosed
US-6713645-B1 INHIBITING SPLA2 MEDIATED RELEASE OF FATTY ACIDS FOR TREATMENT OF CONDITIONS SUCH AS SEPTIC SHOCK ELI LILLY AND COMPANY 2004-03-30 US disclosed
US-6177440-B1 THERAPY FOR SEPSIS SHOCK; PHOSPHOLIPASE INHBITOR ELI LILLY AND COMPANY 2001-01-23 US disclosed
CN-1240210-A Substituted tricyclic compound LILLY CO ELI (US) 2000-01-05 CN disclosed
EP-0952149-A2 Substituted carbazoles, process for their preparation and their use as sPLA2 inhibitiors ELI LILLY AND COMPANY (US) 1999-10-27 EP disclosed