SCHEMBL22306752

SCHEMBL22306752

Cn1ccc(OCc2cccc(S)c2)n1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.41
MPO P05164 1/20 0.38
FFAR1 O14842 1/20 0.37
ADORA3 P0DMS8 2/20 0.36
JMJD6 Q6NYC1 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
GRM5 P41594 4/20 0.34
KDM1A O60341 1/20 0.32
HRH4 Q9H3N8 1/20 0.32
EPHX2 P34913 1/20 0.32
MAOA P21397 2/20 0.32
MAOB P27338 2/20 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
SCHEMBL22290783 0.82 MAOB (0.51) PKMMAOAMAOB
SCHEMBL31173265 0.82 MAOB (0.51) PKMMAOAMAOB
SCHEMBL12970421 0.81 PKM (0.59) PKMADORA3JMJD6ADORA2AADORA1
SCHEMBL12970186 0.72 PKM (0.42) PKMMAOAMAOB
SCHEMBL19253512 0.71 APP (0.47) MAOB
SCHEMBL17279830 0.69 BRD4 (0.48) PKMFFAR1GRM5HRH4MAOA
SCHEMBL2629335 0.68
SCHEMBL14082762 0.68 IDO1 (0.41) FFAR1MAOB
SCHEMBL17591456 0.67 F10 (0.54) FFAR1MAOAMAOB
SCHEMBL7810321 0.67

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
WO-2020160180-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2020-08-06 WO disclosed