SCHEMBL8925586

SCHEMBL8925586

CCCCC(C)CCC1CCCCC1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.59
MAPT P10636 1/20 0.47
BCHE P06276 1/20 0.39
METAP1 P53582 1/20 0.38
CTSL P07711 1/20 0.38
CTSB P07858 1/20 0.38
CTSK P43235 1/20 0.38
SIGMAR1 Q99720 3/20 0.37
ALOX5 P09917 2/20 0.35
PPARG P37231 2/20 0.35
PTGES O14684 1/20 0.35
PTGS2 P35354 1/20 0.35
PSEN1 P49768 1/20 0.35

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
SCHEMBL7456839 0.98 CYP1A2 (0.56) CYP1A2MAPTBCHEMETAP1CTSL
SCHEMBL9283058 0.94 CYP1A2 (0.57) CYP1A2MAPTBCHEMETAP1SIGMAR1
SCHEMBL11750228 0.85 CYP1A2 (0.48) CYP1A2MAPTBCHEMETAP1SIGMAR1
SCHEMBL23135177 0.85 CYP1A2 (0.47) CYP1A2MAPTBCHESIGMAR1ALOX5
SCHEMBL28482634 0.85 CYP1A2 (0.61) CYP1A2MAPTBCHESIGMAR1
SCHEMBL8455180 0.84 CYP1A2 (0.59) CYP1A2MAPTBCHEMETAP1SIGMAR1
SCHEMBL20819147 0.84 CYP1A2 (0.43) CYP1A2MAPTMETAP1SIGMAR1
SCHEMBL19645297 0.82 SIGMAR1 (0.53) CYP1A2MAPTMETAP1SIGMAR1
SCHEMBL21228864 0.82 MAPT (0.50) CYP1A2MAPT
Butylcyclohexane SCHEMBL28304964 0.82 CYP1A2 (0.62) CYP1A2MAPTBCHESIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5614124-A OILS WITH ANTIOXIDANT-DISPERSANTS OF POLYOLEFIN SUCCINIMIDE AND PHENOTHIAZINE ETHYL ADDITIVES CORPORATION (US) 1997-03-25 US disclosed