SCHEMBL28119855

SCHEMBL28119855

O=C(O)C1(CCCCO)CCCCC1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 8/20 0.58
CYP4A11 Q02928 8/20 0.58
CYP2C19 P33261 1/20 0.52
TBXAS1 P24557 2/20 0.49
CPB2 Q96IY4 5/20 0.36
ITGB1 P05556 1/20 0.34
ITGA4 P13612 1/20 0.34
GPR84 Q9NQS5 1/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33

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
SCHEMBL22399923 0.98 CYP4F2 (0.59) CYP4F2CYP4A11CYP2C19TBXAS1CPB2
SCHEMBL8432121 0.92 CYP4F2 (0.58) CYP4F2CYP4A11CYP2C19TBXAS1CPB2
SCHEMBL9177447 0.91 CYP2C19 (0.60) CYP4F2CYP4A11CYP2C19TBXAS1CPB2
SCHEMBL9182839 0.91 CYP2C19 (0.60) CYP4F2CYP4A11CYP2C19TBXAS1CPB2
SCHEMBL11226563 0.91 CYP4F2 (0.50) CYP4F2CYP4A11CYP2C19TBXAS1GPR84
SCHEMBL9177719 0.89 CYP2C19 (0.58) CYP4F2CYP4A11CYP2C19TBXAS1CPB2
SCHEMBL10257161 0.89 CYP4F2 (0.53) CYP4F2CYP4A11CYP2C19TBXAS1CPB2
SCHEMBL9182262 0.89 CYP2C19 (0.58) CYP4F2CYP4A11CYP2C19TBXAS1CPB2
SCHEMBL17099452 0.89 CYP4F2 (0.53) CYP4F2CYP4A11CYP2C19TBXAS1CPB2
SCHEMBL9181319 0.89 CYP2C19 (0.56) CYP4F2CYP4A11CYP2C19TBXAS1CPB2

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-108283000-A PRODRUGS OF GAMMA-HYDROXYBUTYRIC ACID, COMPOSITIONS AND USES THEREOF 凯瑞康宁生物工程(武汉)有限公司 2018-07-13 CN disclosed
CN-106316825-A Preparing method for trans- 4- hydroxycyclohexanecarboxylic acid 泰州精英化成医药科技有限公司 2017-01-11 CN disclosed