SCHEMBL22855632

SCHEMBL22855632

CC(C)(C)OC(=O)N1CCC(Nc2ccc3c(c2)C(=O)NCC32CC2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.53
▸ NPC1 O15118 2/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ MAPT P10636 2/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ GPR119 Q8TDV5 6/20 0.51
▸ DDB1 Q16531 1/20 0.48
▸ CRBN Q96SW2 1/20 0.48
▸ PTPN2 P17706 1/20 0.43
▸ PTPN1 P18031 1/20 0.43
▸ PTPN6 P29350 1/20 0.43
▸ PIM1 P11309 1/20 0.42
▸ PIM2 Q9P1W9 1/20 0.42
▸ FPR3 P25089 1/20 0.41
▸ FPR2 P25090 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ CNR1 P21554 1/20 0.41

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
SCHEMBL22855472 0.86 PRMT5 (0.47) MAPTCRBNPIM1PIM2JAK1
SCHEMBL28502959 0.85 PRMT5 (0.38) MAPTDDB1CRBN
SCHEMBL22855681 0.82 PRMT5 (0.44) MAPTHTTCRBNPIM1PIM2
SCHEMBL22855214 0.80 GFER (0.38) PTPN1JAK1
SCHEMBL22855475 0.75 ALDH1A1 (0.45) ALDH1A1NPC1RAB9AMAPTPTPN2
SCHEMBL10269535 0.74 ALDH1A1 (0.63) ALDH1A1NPC1RAB9AMAPTMAPK1
SCHEMBL22855213 0.74 CDC7 (0.33) DDB1CRBNPIM1PIM2
SCHEMBL1704497 0.74 ALDH1A1 (0.68) ALDH1A1NPC1RAB9AMAPTMAPK1
SCHEMBL28811700 0.73 ALDH1A1 (0.61) ALDH1A1NPC1RAB9AMAPTMAPK1
SCHEMBL29992015 0.73 ALDH1A1 (0.69) ALDH1A1NPC1RAB9AMAPTMAPK1

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
CN-112125886-B Tricyclic compounds as PRMT5 inhibitors and application thereof 南京圣和药物研发有限公司 2023-06-23 — — CN disclosed
WO-2020259478-A1 TRICYCLIC COMPOUND AS PRMT5 INHIBITOR AND APPLICATION THEREOF 南京圣和药物研发有限公司 2020-12-30 — — WO disclosed
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