SCHEMBL3819929

SCHEMBL3819929

C[C@@H](O)COc1c(N)ccc(F)c1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
CYP2C19 P33261 1/20 0.39
SCN4A P35499 3/20 0.32
SCN5A Q14524 3/20 0.32
TSHR P16473 2/20 0.32
SCN1A P35498 2/20 0.32
SCN9A Q15858 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
NFKB1 P19838 1/20 0.32
KCNK3 O14649 1/20 0.32
CACNA1F O60840 1/20 0.32
KCNK2 O95069 1/20 0.32
GBA1 P04062 1/20 0.32
MAOA P21397 1/20 0.32
HTR2A P28223 1/20 0.32
SLC6A4 P31645 1/20 0.32
HTR2B P41595 1/20 0.32

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
SCHEMBL3819931 1.00 LMNA (0.44) LMNACYP2C19SCN4ASCN5ATSHR
SCHEMBL29137878 0.80 CDK1 (0.37)
SCHEMBL6649379 0.77 L3MBTL1 (0.41) LMNATSHRCYP3A4HTR2AHTR2B
SCHEMBL8947859 0.76 PARP1 (0.35) HTR2AHTR2B
SCHEMBL10433858 0.76 LMNA (0.30) LMNA
SCHEMBL10433859 0.76 LMNA (0.30) LMNA
SCHEMBL10434090 0.75 CDK1 (0.30)
SCHEMBL10434092 0.75 CDK1 (0.30)
SCHEMBL10434089 0.75 CDK1 (0.30)
SCHEMBL9792998 0.75 CYP2C19 (0.50) LMNACYP2C19SCN4ASCN5ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1367132-B1 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE PROPOXYANILINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2009-08-12 EP disclosed
EP-1367132-B1 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE PROPOXYANILINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2009-08-12 EP disclosed
US-7217560-B2 Process for preparation of optically active propoxyaniline derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-05-15 US disclosed
US-7217560-B2 Process for preparation of optically active propoxyaniline derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-05-15 US disclosed
US-7217560-B2 Process for preparation of optically active propoxyaniline derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-05-15 US disclosed
US-20040077060-A1 Process for preparation optically active propoxyaniline derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-22 US disclosed
EP-1367132-A1 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE PROPOXYANILINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-12-03 EP disclosed
EP-0322815-B1 Propoxybenzene derivatives and process for preparing the same DAIICHI SEIYAKU CO (JP) 1996-05-15 EP disclosed
US-5312999-A Propoxybenzene derivatives and process for preparing the same DAIICHI SEIYAKU CO., LTD. (JP) 1994-05-17 US disclosed
EP-0322815-A2 Propoxybenzene derivatives and process for preparing the same DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1989-07-05 EP disclosed