SCHEMBL19392017

SCHEMBL19392017

CC(C)(CCOC(C)(C)C(=O)O)OCC(=O)O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL12768993 0.84 SMN1; SMN2 (0.32) TSHRSMN1; SMN2
SCHEMBL25855715 0.82 DGAT1 (0.32)
SCHEMBL12647303 0.81 PPARG (0.32)
SCHEMBL18490901 0.81 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL18906646 0.81 ALDH1A1 (0.35) SMN1; SMN2
SCHEMBL10301446 0.81 HMGCR (0.37) CYP2D6TSHRCYP2C19HIF1ASMN1; SMN2
SCHEMBL24813555 0.80 ALDH1A1 (0.38) TSHRSMN1; SMN2
SCHEMBL12647301 0.80 ALDH1A1 (0.32) TSHR
SCHEMBL21229445 0.77
SCHEMBL19864890 0.76 ALDH1A1 (0.31)

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
EP-2960691-B1 NEAR-INFRARED ABSORBING COMPOSITION, NEAR-INFRARED BLOCKING FILTER, METHOD FOR PRODUCING NEAR-INFRARED BLOCKING FILTER, CAMERA MODULE AND METHOD FOR MANUFACTURING CAMERA MODULE FUJIFILM CORP (JP) 2017-09-27 EP disclosed