SCHEMBL22945910

SCHEMBL22945910

CCOC1CC(N)(C(=O)OC)C1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
EPHX1 P07099 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
SCHEMBL24488794 1.00 MGAM (0.31) MGAMGAASIMGAM2EPHX1
Hydrochloric Acid SCHEMBL28702703 0.98 MGAM (0.30) MGAMGAASIMGAM2
SCHEMBL22945696 0.85 GAA (0.35) MGAMGAASIMGAM2
SCHEMBL31462441 0.85 GAA (0.35) MGAMGAASIMGAM2
SCHEMBL3768299 0.84 EPHX1 (0.35) EPHX1
SCHEMBL3768303 0.84 EPHX1 (0.35) EPHX1
SCHEMBL3768302 0.84 EPHX1 (0.35) EPHX1
Hydrochloric Acid SCHEMBL28715389 0.84 GAA (0.34) MGAMGAASIMGAM2
SCHEMBL18736369 0.82 MMP1 (0.34) EPHX1
Hydrochloric Acid SCHEMBL20515392 0.81 MMP1 (0.33) EPHX1

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
CN-114206832-A Urea compounds antagonizing LPA1 receptor 大正制药株式会社 2022-03-18 CN disclosed
WO-2021020429-A1 UREA COMPOUND FOR ANTAGONIZING LPA1 RECEPTOR 大正製薬株式会社 2021-02-04 WO disclosed