SCHEMBL31357705

SCHEMBL31357705

CC(C)(C)OC(=O)C(C)(C)Cc1cccc(-c2nc(Cl)ccc2F)c1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.35
DGAT1 O75907 1/20 0.35
PLAU P00749 5/20 0.34
PLG P00747 4/20 0.34
PLAT P00750 3/20 0.34
EGFR P00533 2/20 0.34
AURKB Q96GD4 1/20 0.34
CTSS P25774 2/20 0.33
CTSK P43235 2/20 0.33
CTSB P07858 1/20 0.33
SHMT1 P34896 2/20 0.33
SHMT2 P34897 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
KDM4E B2RXH2 1/20 0.32
APP P05067 1/20 0.32
CCNT1 O60563 1/20 0.32
ATM Q13315 1/20 0.32
NR3C1 P04150 1/20 0.32

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
SCHEMBL28809392 1.00 CTSL (0.35) CTSLDGAT1PLAUPLGPLAT
SCHEMBL31357614 0.89 PLAU (0.36) DGAT1PLAUPLGPLAT
SCHEMBL31357691 0.89 PLAU (0.36) DGAT1PLAUPLGPLAT
SCHEMBL23595147 0.89 PLAU (0.36) DGAT1PLAUPLGPLAT
SCHEMBL31357651 0.88 CNR2 (0.37) CTSLDGAT1CTSSCTSKCTSB
SCHEMBL28809474 0.88 CNR2 (0.37) CTSLDGAT1CTSSCTSKCTSB
SCHEMBL23582452 0.86 SHMT1 (0.40) PLAUPLGPLATSHMT1SHMT2
SCHEMBL23582711 0.85 DGAT1 (0.37) DGAT1PLAUPLGPLATCCNT1
SCHEMBL31357628 0.85 DGAT1 (0.37) DGAT1PLAUPLGPLATCCNT1
SCHEMBL31357685 0.84 EGFR (0.35) DGAT1EGFRAURKBAPP

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-114846013-B Novel aminoaryl derivatives useful as diacylglycerol acyltransferase 2 inhibitors and uses thereof 株式会社LG化学 2024-12-20 CN disclosed