SCHEMBL24319781

SCHEMBL24319781

COC(OC)C1CN(c2ccc(C=O)c(Br)c2)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
PRKDC P78527 2/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
POLB P06746 2/20 0.40
PKM P14618 1/20 0.37
PIK3CD O00329 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CB P42338 1/20 0.34
PIK3CG P48736 1/20 0.34
MAOB P27338 1/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
FGFR1 P11362 1/20 0.32
KDM4E B2RXH2 1/20 0.30
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL25134014 0.86 ALDH1A1 (0.47) ALDH1A1PRKDCNPC1RAB9APOLB
SCHEMBL29927711 0.86 ALDH1A1 (0.47) ALDH1A1PRKDCNPC1RAB9APOLB
SCHEMBL27370423 0.79 ALDH1A1 (0.36) ALDH1A1PRKDCNPC1RAB9APOLB
SCHEMBL24319289 0.78 ALDH1A1 (0.36) ALDH1A1NPC1RAB9APOLBLMNA
SCHEMBL23753987 0.78 IP6K1 (0.38) ALDH1A1PRKDCNPC1RAB9APOLB
SCHEMBL30635253 0.76 MYC (0.38) ALDH1A1LMNAMAPTHPGDKDM4E
SCHEMBL24319779 0.76 MYC (0.38) ALDH1A1LMNAMAPTHPGDKDM4E
SCHEMBL23754172 0.74 NPC1 (0.35) ALDH1A1PRKDCNPC1RAB9APOLB
SCHEMBL29148153 0.74 IGF1R (0.38) POLBLMNAMAPTSMN1; SMN2L3MBTL1
SCHEMBL15475184 0.72 ALDH1A1 (0.56) ALDH1A1PRKDCNPC1RAB9APKM

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-2022047145-A1 RAPIDLY ACCELERATING FIBROSARCOMA PROTEIN DEGRADING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2022-03-03 WO disclosed