SCHEMBL7601276

SCHEMBL7601276

CCCCCOC(=O)c1ccc(N(CC)CC)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.63
NPC1 O15118 1/20 0.63
MAPT P10636 1/20 0.63
RAB9A P51151 1/20 0.63
LMNA P02545 4/20 0.59
TSHR P16473 4/20 0.59
CYP1A2 P05177 3/20 0.59
CYP2C19 P33261 2/20 0.59
CYP2D6 P10635 2/20 0.59
MAPK1 P28482 2/20 0.59
ESR1 P03372 2/20 0.59
NR1H2 P55055 1/20 0.59
RNASEL Q05823 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
CYP3A4 P08684 3/20 0.58
CYP2C9 P11712 1/20 0.58
PDE4D Q08499 1/20 0.58
HPGD P15428 1/20 0.56
RECQL P46063 1/20 0.56
STS P08842 6/20 0.56

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
SCHEMBL5709852 0.98 ALDH1A1 (0.66) ALDH1A1NPC1MAPTRAB9ALMNA
SCHEMBL148292 0.89 ALDH1A1 (0.64) ALDH1A1NPC1MAPTRAB9ALMNA
SCHEMBL18821721 0.87 ESR1 (0.56) ALDH1A1NPC1MAPTRAB9ALMNA
SCHEMBL18821739 0.87 ESR1 (0.56) ALDH1A1NPC1MAPTRAB9ALMNA
SCHEMBL63768 0.87 LMNA (0.55) ALDH1A1NPC1MAPTRAB9ALMNA
SCHEMBL1994995 0.87 ALDH1A1 (0.80) ALDH1A1NPC1MAPTRAB9ALMNA
Padimate A SCHEMBL15372 0.86 ALDH1A1 (0.65) ALDH1A1NPC1MAPTRAB9ALMNA
SCHEMBL9355782 0.85 ALDH1A1 (0.83) ALDH1A1NPC1MAPTRAB9ALMNA
SCHEMBL197446 0.85 ALDH1A1 (0.83) ALDH1A1NPC1MAPTRAB9ALMNA
SCHEMBL108412 0.85 ALDH1A1 (0.83) ALDH1A1NPC1MAPTRAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0492007-B1 Process for producing liquid loaded powders FAULDING F H & CO LTD (AU) 1995-02-08 EP claimed
EP-0492007-A1 Process for producing liquid loaded powders F.H. FAULDING & CO. LIMITED (AU) 1992-07-01 EP claimed
WO-2002013850-A1 USE OF COLOSTRININ, CONSTITUENT PEPTIDES THEREOF, AND ANALOGS THEREOF AS OXIDATIVE STRESS REGULATORS THE UNIVERSITY OF TEXAS SYSTEM (US) 2002-02-21 WO disclosed
US-4136165-A SUNSCREEN AGENTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1979-01-23 US disclosed