SCHEMBL28396557

SCHEMBL28396557

CC(C(=O)O)=C(C)C1(CO)CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.41
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
MME P08473 3/20 0.32
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
TSHR P16473 1/20 0.31
BLM P54132 1/20 0.31
CACNA2D1 P54289 1/20 0.31
SMN1; SMN2 Q16637 1/20 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
SCHEMBL479238 0.84 CYP2C19 (0.41) CYP2C19MMEUSP2ALDH1A1LMNA
SCHEMBL11257060 0.76 CYP2C19 (0.43) CYP2C19CYP4F2CYP4A11MMEUSP2
SCHEMBL28223517 0.75 CYP2C19 (0.34) CYP2C19MME
SCHEMBL18235 0.73 CYP2C19 (0.62) CYP2C19CYP4F2CYP4A11MMEUSP2
SCHEMBL479261 0.72 ALDH1A1 (0.41) CYP2C19ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL19552499 0.72 CYP2C19 (0.60) CYP2C19CYP4F2CYP4A11MMEUSP2
SCHEMBL2277073 0.71 CYP2C19 (0.58) CYP2C19CYP4F2CYP4A11MMEUSP2
SCHEMBL11517742 0.71 CYP2C19 (0.46) CYP2C19CYP4F2CYP4A11MMEUSP2
SCHEMBL166447 0.71 CYP2C19 (0.39) CYP2C19MME
SCHEMBL19388785 0.70 CYP2C19 (0.41) CYP2C19CYP4F2CYP4A11MMEUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111123644-A Photosensitive resin composition, display, and method for forming pattern of display 株式会社东进世美肯 2020-05-08 CN claimed