SCHEMBL8090529

SCHEMBL8090529

CCCCCC(CCCCC)(CC(=O)O)C(=O)OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.44
TDP1 Q9NUW8 3/20 0.39
FFAR1 O14842 1/20 0.39
CPT2 P23786 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPT P10636 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
AKR1B1 P15121 1/20 0.39
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
PPARG P37231 3/20 0.38
PPARD Q03181 3/20 0.38
PPARA Q07869 3/20 0.38
TSHR P16473 2/20 0.38
GPR84 Q9NQS5 2/20 0.38
HDAC11 Q96DB2 2/20 0.38
ALDH1A1 P00352 1/20 0.38
SLC22A6 Q4U2R8 1/20 0.38

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
SCHEMBL6863982 0.93 EPHX1 (0.42) EPHX1TDP1FFAR1CPT2MEN1
SCHEMBL6871631 0.91 EPHX1 (0.44) EPHX1TDP1FFAR1CPT2MEN1
SCHEMBL6868543 0.91 EPHX1 (0.44) EPHX1TDP1FFAR1CPT2MEN1
SCHEMBL6863202 0.91 EPHX1 (0.44) EPHX1TDP1FFAR1CPT2MEN1
SCHEMBL6869354 0.91 EPHX1 (0.44) EPHX1TDP1FFAR1CPT2MEN1
SCHEMBL6870912 0.91 EPHX1 (0.44) EPHX1TDP1FFAR1CPT2MEN1
SCHEMBL6873863 0.91 EPHX1 (0.44) EPHX1TDP1FFAR1CPT2MEN1
SCHEMBL6873371 0.91 EPHX1 (0.44) EPHX1TDP1FFAR1CPT2MEN1
SCHEMBL6873202 0.91 EPHX1 (0.44) EPHX1TDP1FFAR1CPT2MEN1
SCHEMBL28048453 0.91 EPHX1 (0.39) EPHX1TDP1FFAR1CPT2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6150304-A HERBICIDES, INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2000-11-21 US disclosed
US-5840661-A HERBICIDES OR INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1998-11-24 US disclosed