SCHEMBL21438564

SCHEMBL21438564

Nc1nnc(Cl)cc1N1CC2CCC(C1)N2c1ccnc(OCCN2CCN(C(=O)O)CC2)c1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SMARCA2 P51531 6/20 0.51
▸ SMARCA4 P51532 6/20 0.51
▸ VHL P40337 2/20 0.36
▸ SIGMAR1 Q99720 3/20 0.34
▸ KCNH2 Q12809 2/20 0.34
▸ KDM1A O60341 1/20 0.34
▸ HTR4 Q13639 2/20 0.33
▸ DRD3 P35462 1/20 0.33
▸ KCNA5 P22460 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ CYP4F2 P78329 1/20 0.31

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
SCHEMBL21405369 0.90 SMARCA2 (0.50) SMARCA2SMARCA4VHLSIGMAR1KCNH2
SCHEMBL29838301 0.90 SMARCA2 (0.50) SMARCA2SMARCA4VHLSIGMAR1KCNH2
SCHEMBL30469009 0.88 SMARCA2 (0.50) SMARCA2SMARCA4VHLDRD3
SCHEMBL25201422 0.88 SMARCA2 (0.50) SMARCA2SMARCA4VHLDRD3
SCHEMBL30469012 0.88 SMARCA2 (0.50) SMARCA2SMARCA4VHLDRD3
SCHEMBL21439162 0.82 SMARCA2 (0.63) SMARCA2SMARCA4VHLKMT2A
SCHEMBL25267215 0.81 SMARCA2 (0.47) SMARCA2SMARCA4VHLDRD3
SCHEMBL29362646 0.81 SMARCA2 (0.47) SMARCA2SMARCA4VHLDRD3
SCHEMBL25206583 0.81 SMARCA2 (0.47) SMARCA2SMARCA4VHLDRD3
SCHEMBL21405286 0.81 SMARCA2 (0.58) SMARCA2SMARCA4

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-3774789-A1 BRM TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE Arvinas Operations, Inc. (US) 2021-02-17 — — EP disclosed
WO-2019195201-A1 BRM TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2019-10-10 — — WO disclosed
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