SCHEMBL28217892

SCHEMBL28217892

CCC1(C(=O)O)C(O)C1(C)C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
FFAR3 O14843 2/20 0.31

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
SCHEMBL9402309 0.78 CYP2C19 (0.32) ALDH1A1
SCHEMBL11352695 0.78 TDP1 (0.31) ALDH1A1
SCHEMBL10689140 0.76 LMNA (0.36)
SCHEMBL11216997 0.76 LMNA (0.36)
SCHEMBL9238840 0.76 LMNA (0.36)
SCHEMBL9516684 0.75 PTGS2 (0.31)
Hydrochloric Acid SCHEMBL9718743 0.74 LMNA (0.35)
SCHEMBL27712316 0.72 FFAR3 (0.32) ALDH1A1FFAR3
SCHEMBL10828662 0.72
SCHEMBL11004227 0.69

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-108238941-A The synthetic method of 3- tribromo-acetyl base -2,2- dimethyl cyclopropane carboxylic acid's ethyl ester drugs 成都切斯特科技有限公司 2018-07-03 CN claimed
CN-108238941-A The synthetic method of 3- tribromo-acetyl base -2,2- dimethyl cyclopropane carboxylic acid's ethyl ester drugs 成都切斯特科技有限公司 2018-07-03 CN disclosed