SCHEMBL8712246

SCHEMBL8712246

[CH2]Cc1ccc(O[Si](C)(C)CCCC)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP2D6 P10635 5/20 0.32
CYP1A2 P05177 4/20 0.32
CYP19A1 P11511 3/20 0.32
CYP2C9 P11712 3/20 0.32
CYP2C19 P33261 3/20 0.32
CYP3A4 P08684 2/20 0.32
LMNA P02545 2/20 0.31
GAA P10253 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 2/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CASP3 P42574 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
SCHEMBL4872803 0.86 CYP19A1 (0.34) CYP2D6CYP1A2CYP19A1CYP2C9CYP2C19
SCHEMBL10584058 0.80 ACHE (0.37) MEN1KMT2ACYP2D6CYP1A2CYP19A1
SCHEMBL8904260 0.79 TDP1 (0.44) CYP1A2CYP2C9CYP2C19CYP3A4LMNA
SCHEMBL6585059 0.79 MGLL (0.43) CYP2D6CYP1A2CYP19A1CYP2C9CYP2C19
SCHEMBL8904259 0.79 CYP2D6 (0.33) CYP2D6CYP1A2CYP19A1CYP2C9CYP2C19
SCHEMBL5074489 0.79 LTA4H (0.50) MEN1KMT2ACYP2D6CYP1A2CYP2C19
SCHEMBL20535808 0.79 APP (0.34) CYP2D6CYP1A2CYP19A1CYP2C9CYP2C19
SCHEMBL6987433 0.78 LTA4H (0.46) KMT2ACYP2D6CYP1A2CYP19A1CYP2C9
SCHEMBL5991362 0.78 CHRNB2 (0.41) THRBCYP2D6CYP1A2CYP19A1CYP2C9
SCHEMBL8709350 0.75 ALDH1A1 (0.33) CYP3A4TP53ALDH1A1SMN1; SMN2TSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0540854-B1 Preparation for promoting hair growth SANSHO SEIYAKU KK (JP) 1998-01-21 EP disclosed
US-5656264-A ADMINISTERING TO THE SCALP OF THE MALE A PREPERATION CONSITING OF 6-BENZYLAMINOPURINE SANSYO SEIYAKU CO., LTD. (JP) 1997-08-12 US disclosed
EP-0540854-A2 Preparation for promoting hair growth Sansho Seiyaku Co., Ltd. (JP) 1993-05-12 EP disclosed