SCHEMBL8709348

SCHEMBL8709348

C[CH]c1ccc(O[Si](C)(C)C)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
CYP1A2 P05177 2/20 0.33
CYP2A6 P11509 1/20 0.33
NPC1 O15118 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.31
TRPA1 O75762 1/20 0.31
RELA Q04206 1/20 0.31
ESR1 P03372 2/20 0.30
ALDH1A3 P47895 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
SCHEMBL28735682 0.82 CYP3A4 (0.59) CYP3A4KDM4EALDH1A1LMNATP53
SCHEMBL4763549 0.82 CA1 (0.39) ALDH1A1
SCHEMBL8708669 0.79 KDM4E (0.32) CYP3A4KDM4EALDH1A1LMNATP53
SCHEMBL410818 0.79 ALDH1A1 (0.50) CYP3A4KDM4EALDH1A1LMNATP53
SCHEMBL3438230 0.79 ALDH1A1 (0.58) KDM4EALDH1A1LMNACYP2A6HPGD
SCHEMBL9266383 0.74 KDM4E (0.41) CYP3A4KDM4EALDH1A1LMNATP53
SCHEMBL21356554 0.74 CYP1A1 (0.57) CYP3A4KDM4ELMNATP53CYP1A2
SCHEMBL9266380 0.74 KDM4E (0.41) CYP3A4KDM4EALDH1A1LMNATP53
SCHEMBL8708812 0.74 CHRM5 (0.40) LMNACYP1A2MAPTRELACYP1A1
SCHEMBL17881929 0.74 ESR2 (0.39) CYP3A4KDM4EALDH1A1TP53NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-63101426-A None JP disclosed
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
JP-S63101426-A ALKALI-SOLUBLE LADDER SILICONE POLYMER HITACHI LTD 1988-05-06 JP disclosed