SCHEMBL5406832

SCHEMBL5406832

CCCCC1OC(=O)C=CC=C1O

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.38
MAOB P27338 3/20 0.33
ABHD16A O95870 1/20 0.33
GRM2 Q14416 3/20 0.33
PPARG P37231 1/20 0.32
CYP1A2 P05177 2/20 0.32
PDCD4 Q53EL6 6/20 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
SCHEMBL7963900 0.80 CES2 (0.41) CES2MAOBABHD16AGRM2PPARG
SCHEMBL9993726 0.68 PDCD4 (0.38) CES2GRM2PPARGCYP1A2PDCD4
SCHEMBL504239 0.66
SCHEMBL3662595 0.65 PDCD4 (0.53) GRM2PPARGCYP1A2PDCD4
SCHEMBL698437 0.64 CYP1A2 (0.38) CES2MAOBABHD16AGRM2CYP1A2
SCHEMBL3505080 0.63 PDCD4 (0.40) CES2GRM2PPARGCYP1A2PDCD4
Oxalic Acid SCHEMBL31339542 0.62 POLB (0.39) CES2ABHD16AGRM2
SCHEMBL5361290 0.62 CES2 (0.44) CES2MAOBABHD16A
SCHEMBL3663425 0.62 PDCD4 (0.43) CES2GRM2PPARGCYP1A2PDCD4
SCHEMBL11157363 0.62 CES2 (0.38) CES2MAOBABHD16ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276570-B2 Compositions for golf equipment ACUSHNET COMPANY (US) 2007-10-02 US disclosed
US-7265195-B2 Compositions for golf equipment ACUSHNET COMPANY (US) 2007-09-04 US disclosed
US-20050272900-A1 Compositions for golf equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2005-12-08 US disclosed
US-20050272909-A1 Compositions for golf equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2005-12-08 US disclosed
US-20050272529-A1 Compositions for golf equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2005-12-08 US disclosed