SCHEMBL28685236

SCHEMBL28685236

c1ccc([SiH](OCc2ccc(C3COC3)cc2)c2ccccc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
FFAR4 Q5NUL3 1/20 0.33
TAAR1 Q96RJ0 1/20 0.32
LTA4H P09960 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
SCHEMBL863694 0.76 TSHR (0.50)
SCHEMBL27038186 0.73 LMNA (0.53)
SCHEMBL8212527 0.70 TSHR (0.52) TMEM97SIGMAR1TAAR1
SCHEMBL22732111 0.69 FFAR4 (0.33) FFAR4
SCHEMBL22717266 0.68 SMYD2 (0.37) FFAR4
SCHEMBL27214476 0.67 NPC1 (0.48) TAAR1
SCHEMBL28032871 0.66 TDP1 (0.55)
SCHEMBL29060525 0.66 TSHR (0.39) TAAR1
SCHEMBL21753894 0.66 IDO1 (0.53)
SCHEMBL28690743 0.66 NAAA (0.34) FFAR4

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-114127062-A Thiadiazolyl derivatives as inhibitors of DNA polymerase Theta 伊迪亚生物科学有限公司 2022-03-01 CN disclosed