SCHEMBL11222381

SCHEMBL11222381

CC[C@H]1CC[C@H]([C@H]2CC[C@H](C(=O)Oc3ccccc3F)CC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.51
POLB P06746 2/20 0.46
MEN1 O00255 1/20 0.46
RAB9A P51151 1/20 0.46
KMT2A Q03164 1/20 0.46
NPC1 O15118 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
NCEH1 Q6PIU2 1/20 0.39
HPGD P15428 2/20 0.39
FAAH O00519 2/20 0.38
KDM4E B2RXH2 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL11222382 1.00 L3MBTL1 (0.51) L3MBTL1POLBMEN1RAB9AKMT2A
SCHEMBL11033321 0.87 POLB (0.44) L3MBTL1POLBMEN1RAB9AKMT2A
SCHEMBL10926531 0.87 POLB (0.44) L3MBTL1POLBMEN1RAB9AKMT2A
SCHEMBL11032038 0.85 SMN1; SMN2 (0.41) L3MBTL1POLBMEN1RAB9AKMT2A
SCHEMBL11032040 0.85 SMN1; SMN2 (0.41) L3MBTL1POLBMEN1RAB9AKMT2A
SCHEMBL28393952 0.84 L3MBTL1 (0.65) L3MBTL1POLBMEN1RAB9AKMT2A
SCHEMBL11128750 0.83 USP30 (0.45) POLBMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL11128748 0.83 USP30 (0.45) POLBMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL11130670 0.81 KMT2A (0.49) POLBKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL11293857 0.81 ELANE (0.54) L3MBTL1POLBMEN1RAB9AKMT2A

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
JP-57192335-A None JP disclosed
JP-S57192335-A TRANS-4-(TRANS-4'-ALKYLCYCLOHEXYL)CYCLOHEXANECARBOXYLIC ACID 2-HALOGENOPHENYL ESTER CHISSO CORP 1982-11-26 JP disclosed