SCHEMBL10545907

SCHEMBL10545907

CC1(C)C(C=CC(=O)OC2CCCC2)C1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.33
UGT2B7 P16662 3/20 0.31
NAAA Q02083 2/20 0.31
CYP2C19 P33261 1/20 0.31
HTT P42858 1/20 0.30
FABP7 O15540 1/20 0.30
FABP5 Q01469 1/20 0.30

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
SCHEMBL11135709 1.00 EPHX1 (0.33) EPHX1UGT2B7NAAACYP2C19HTT
SCHEMBL10545904 1.00 EPHX1 (0.33) EPHX1UGT2B7NAAACYP2C19HTT
SCHEMBL10936453 0.98 EPHX1 (0.35) EPHX1UGT2B7NAAACYP2C19HTT
SCHEMBL11134797 0.98 EPHX1 (0.35) EPHX1UGT2B7NAAACYP2C19HTT
SCHEMBL10936450 0.98 EPHX1 (0.35) EPHX1UGT2B7NAAACYP2C19HTT
SCHEMBL11134795 0.98 EPHX1 (0.35) EPHX1UGT2B7NAAACYP2C19HTT
SCHEMBL10940101 0.97 UGT2B7 (0.31) UGT2B7HTT
SCHEMBL10940105 0.97 UGT2B7 (0.31) UGT2B7HTT
SCHEMBL10545558 0.97 UGT2B7 (0.31) UGT2B7HTT
SCHEMBL10547819 0.97 UGT2B7 (0.31) UGT2B7HTT

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
US-4833163-A INSECTICIDES, NEMATOCIDES, MITICIDES ROUSSEL UCLAF (FR) 1989-05-23 US disclosed
EP-0041021-B1 CYCLOPROPANE CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION, THEIR USE AGAINST PARASITES IN PLANTS AND ANIMALS, THEIR COMPOSITIONS AND THEIR INTERMEDIATES ROUSSEL-UCLAF (FR) 1984-07-25 EP disclosed
US-4402972-A INSECTICIDES ROUSSEL UCLAF (FR) 1983-09-06 US disclosed
EP-0041021-A2 Cyclopropane carboxylic acid derivatives, their preparation, their use against parasites in plants and animals, their compositions and their intermediates ROUSSEL-UCLAF (FR) 1981-12-02 EP disclosed