SCHEMBL7747845

SCHEMBL7747845

CCc1[nH]c2cccc(O)c2c1Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.43
HTR2C P28335 1/20 0.43
IMPDH2 P12268 1/20 0.42
IMPDH1 P20839 1/20 0.42
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 2/20 0.41
PLA2G2A P14555 2/20 0.39
PARP1 P09874 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
HPGD P15428 2/20 0.38
TSHR P16473 2/20 0.38
CYP2C19 P33261 2/20 0.38
MTNR1A P48039 2/20 0.38
MTNR1B P49286 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
MEN1 O00255 1/20 0.38
CYP2C9 P11712 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL7996132 0.74 PLA2G2A (0.47) ALDH1A1KDM4EPLA2G2ACYP1A2CYP3A4
SCHEMBL8912928 0.71 HTR2A (0.65) HTR2AHTR2CIMPDH2IMPDH1ALDH1A1
SCHEMBL7694495 0.71 HSP90AA1 (0.44) ALDH1A1PLA2G2ACYP1A2CYP3A4HPGD
SCHEMBL7694116 0.70 PDE10A (0.42) ALDH1A1KDM4EMTNR1AMTNR1B
SCHEMBL6158092 0.69 HSP90AA1 (0.50) MEN1KMT2ABCL2BCL2L1
SCHEMBL875676 0.69 BCL2 (0.54) ALDH1A1KDM4ECYP3A4HPGDTDP1
SCHEMBL9259113 0.67 MEN1 (0.64) HTR2AHTR2CALDH1A1KDM4ETDP1
SCHEMBL6158089 0.66 BCL2 (0.52) HTR2ACYP3A4HPGDMEN1KMT2A
SCHEMBL12668737 0.66 DAO (0.50) HTR2AHTR2CIMPDH2IMPDH1ALDH1A1
SCHEMBL3632559 0.66 PLA2G2A (0.39) HTR2AHTR2CALDH1A1KDM4EPLA2G2A

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-1071661-A4 PROCESS FOR PREPARING 4-HYDROXY INDOLE, INDAZOLE AND CARBAZOLE COMPOUNDS LILLY CO ELI (US) 2001-08-22 EP disclosed
EP-1071661-A1 PROCESS FOR PREPARING 4-HYDROXY INDOLE, INDAZOLE AND CARBAZOLE COMPOUNDS ELI LILLY AND COMPANY (US) 2001-01-31 EP disclosed
WO-1999054295-A1 PROCESS FOR PREPARING 4-HYDROXY INDOLE, INDAZOLE AND CARBAZOLE COMPOUNDS ELI LILLY AND COMPANY (US) 1999-10-28 WO disclosed