SCHEMBL7476830

SCHEMBL7476830

[CH2]CCc1cccc(C(=O)OCCC)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
CYP4F2 P78329 3/20 0.56
CYP4A11 Q02928 3/20 0.56
ALDH1A1 P00352 4/20 0.51
MAPT P10636 3/20 0.49
KMT2A Q03164 1/20 0.49
TSHR P16473 2/20 0.47
ESR1 P03372 1/20 0.47
CHRM1 P11229 1/20 0.47
SLC6A2 P23975 1/20 0.47
KDR P35968 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 2/20 0.47
POLB P06746 1/20 0.47
SLC7A5 Q01650 1/20 0.45
TYR P14679 1/20 0.45
LOXL2 Q9Y4K0 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
RAB9A P51151 1/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL15344632 0.89 LMNA (0.62) LMNACYP4F2CYP4A11ALDH1A1MAPT
SCHEMBL5544912 0.88 CYP4F2 (0.71) CYP4F2CYP4A11ALDH1A1MAPTKMT2A
SCHEMBL3813671 0.88 LMNA (0.60) LMNACYP4F2CYP4A11ALDH1A1MAPT
SCHEMBL3033016 0.86 LMNA (0.66) LMNACYP4F2CYP4A11ALDH1A1MAPT
SCHEMBL19350853 0.84 CYP4F2 (0.62) LMNACYP4F2CYP4A11ALDH1A1
SCHEMBL3012847 0.83 LMNA (0.54) LMNACYP4F2CYP4A11ALDH1A1MAPT
SCHEMBL29579787 0.83 LMNA (0.54) LMNACYP4F2CYP4A11ALDH1A1MAPT
SCHEMBL13291593 0.82 CYP4F2 (0.62) LMNACYP4F2CYP4A11ALDH1A1MAPT
SCHEMBL3029600 0.82 CYP4F2 (0.56) LMNACYP4F2CYP4A11ALDH1A1MAPT
SCHEMBL111664 0.82 LMNA (0.75) LMNAALDH1A1KMT2ATSHRESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0650476-B1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMA CO LTD (JP) 2002-06-26 EP disclosed
EP-0719258-B1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMA CO LTD (JP) 2001-10-31 EP disclosed
US-6136826-A AMINOPIPERIDINE COMPOUNDS SUBSTITUTED WITH ALKANOYL OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US disclosed
CN-1052224-C Peripheral Vasodilating agent containing N-acylated 4-amino piperidine derivatives as active ingredients OTSUKA PHARMA CO LTD (JP) 2000-05-10 CN disclosed
US-5786367-A OXYGEN SCAVENGERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-07-28 US disclosed
US-5760058-A Peripheral vasodilating agent containing piperidine derivative as active ingredient OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-06-02 US disclosed
US-5656642-A Peripheral vasodilating agent containing piperidine derivative as active ingredient OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-08-12 US disclosed
EP-0719258-A1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-07-03 EP disclosed
WO-1996002508-A1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-02-01 WO disclosed
EP-0650476-A1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-05-03 EP disclosed
WO-1994022826-A1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-10-13 WO disclosed