SCHEMBL8709182

SCHEMBL8709182

[CH2]/C=C(\C)COC(=O)CC

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.38
ALDH1A1 P00352 5/20 0.34
CYP1A2 P05177 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
BLM P54132 1/20 0.34
WRN Q14191 1/20 0.34
HIF1A Q16665 1/20 0.34
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
GAA P10253 2/20 0.31
MGAM O43451 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
SOAT1 P35610 1/20 0.31
TSHR P16473 1/20 0.31
PAM P19021 2/20 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
SCHEMBL8704613 1.00 NAAA (0.38) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL8711516 0.83 ALDH1A1 (0.43) ALDH1A1CYP1A2TSHRPAM
SCHEMBL8711519 0.83 ALDH1A1 (0.43) ALDH1A1CYP1A2TSHRPAM
SCHEMBL8705280 0.79
SCHEMBL8705278 0.79
SCHEMBL1573032 0.78 NAAA (0.38) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL1573031 0.78 NAAA (0.38) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL17865597 0.77 ALDH1A1 (0.40) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL21518276 0.77 NAAA (0.36) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL21518293 0.77 NAAA (0.36) NAAAALDH1A1CYP1A2HPGDCYP2C19

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