SCHEMBL24156699

SCHEMBL24156699

CO[C@@H](C)COc1cc(Br)nc(Br)c1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 2/20 0.40
▸ GRM4 Q14833 4/20 0.32
▸ HPGD P15428 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ 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
SCHEMBL24156700 1.00 GRM5 (0.40) GRM5GRM4HPGDMEN1LMNA
SCHEMBL27083547 1.00 GRM5 (0.40) GRM5GRM4HPGDMEN1LMNA
SCHEMBL24156098 0.86 GRM5 (0.36) GRM5
SCHEMBL27083572 0.86 GRM5 (0.36) GRM5
SCHEMBL24156083 0.86 GRM5 (0.36) GRM5
SCHEMBL27083526 0.83 GRM5 (0.37) GRM5LMNASMN1; SMN2
SCHEMBL24156618 0.83 GRM5 (0.37) GRM5LMNASMN1; SMN2
SCHEMBL24156399 0.83 GRM5 (0.37) GRM5LMNASMN1; SMN2
SCHEMBL31543584 0.78 GRM5 (0.43) GRM5GRM4
SCHEMBL32667230 0.75 CHRNB2 (0.41) —

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-2021259208-A1 TYK-2 INHIBITOR BEIGENE, LTD. (KY) 2021-12-30 — — WO disclosed
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