SCHEMBL31316656

SCHEMBL31316656

COCC1CC(=O)c2cccc(Cl)c2O1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 9/20 0.41
MAOA P21397 1/20 0.36
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
AQP1 P29972 1/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
MAOB P27338 1/20 0.34
RAB9A P51151 1/20 0.34
ABCB1 P08183 2/20 0.34
SIGMAR1 Q99720 1/20 0.34
CA2 P00918 1/20 0.34
SSTR2 P30874 1/20 0.34
SSTR4 P31391 1/20 0.34
SLC22A12 Q96S37 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
SCHEMBL31316737 0.81 SIRT2 (0.40) SIRT2CNR1CNR2ABCB1SIGMAR1
SCHEMBL31316832 0.81 SIRT2 (0.40) SIRT2CNR1CNR2ABCB1SIGMAR1
SCHEMBL8210999 0.72 SSTR2 (0.40) SIRT2AQP1ABCB1SIGMAR1CA2
SCHEMBL31402347 0.70 HTR1A (0.35) MAOAMAPTCA2
SCHEMBL31316885 0.69 HTR2A (0.36) MAOACNR1AQP1MAPTABCB1
SCHEMBL11426094 0.69 SIRT2 (0.46) SIRT2MAOAMAOBABCB1
Hydrochloric Acid SCHEMBL31316984 0.69 HTR2A (0.38) MAOACA2
SCHEMBL22090769 0.67 MRGPRX4 (0.38) CNR1
SCHEMBL14367886 0.67 PRKAB2 (0.40) MAOAAQP1
SCHEMBL15758633 0.66 CA2 (0.38) AQP1CA2

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
EP-4743453-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION Pretzel Therapeutics, Inc. (US) 2026-05-20 EP disclosed
WO-2025015178-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION PRETZEL THERAPEUTICS, INC. (US) 2025-01-16 WO disclosed