SCHEMBL4824546

SCHEMBL4824546

C=C(C(=O)O)C(C)Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.57
CYP3A4 P08684 3/20 0.51
TSHR P16473 1/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.49
CYP1A2 P05177 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
LMNA P02545 1/20 0.47
ALDH1A1 P00352 1/20 0.46
ALPI P09923 1/20 0.46
PKM P14618 1/20 0.46
PTGS1 P23219 1/20 0.46
XIAP P98170 1/20 0.46
SLC7A5 Q01650 1/20 0.46
TRPA1 O75762 1/20 0.46
SLC6A2 P23975 2/20 0.45
TAAR1 Q96RJ0 2/20 0.45

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
SCHEMBL3516107 0.80 HPGD (0.61) HPGDCYP3A4TSHRNPC1RAB9A
SCHEMBL3516102 0.80 HPGD (0.61) HPGDCYP3A4TSHRNPC1RAB9A
SCHEMBL4656025 0.80 CYP1A2 (0.63) HPGDCYP1A2ALPIPKMPTGS1
SCHEMBL3389880 0.80 HPGD (0.61) HPGDCYP3A4TSHRNPC1RAB9A
SCHEMBL11724365 0.80 HPGD (0.56) HPGDCYP3A4TSHRNPC1RAB9A
SCHEMBL265135 0.79 CYP1A2 (0.61) HPGDCYP3A4TSHRNPC1RAB9A
SCHEMBL65930 0.79 CYP1A2 (0.61) HPGDCYP3A4TSHRNPC1RAB9A
SCHEMBL265577 0.79 CYP1A2 (0.61) HPGDCYP3A4TSHRNPC1RAB9A
SCHEMBL22066481 0.79 HPGD (0.59) HPGDCYP3A4TSHRNPC1RAB9A
SCHEMBL7613299 0.79 HPGD (0.59) HPGDCYP3A4TSHRNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021137714-A1 MATERIAL FOR MAKING OPHTHALMOLOGICAL IMPLANTS BY A PHOTOPOLYMERIZATION METHOD Общество с ограниченной ответственностью предприятие "Репер-НН" 2021-07-08 WO claimed
JP-60116152-A None JP disclosed
WO-2021137714-A1 MATERIAL FOR MAKING OPHTHALMOLOGICAL IMPLANTS BY A PHOTOPOLYMERIZATION METHOD Общество с ограниченной ответственностью предприятие "Репер-НН" 2021-07-08 WO disclosed
US-20210061988-A1 RESIN COMPOSITION FOR CARBON FIBER-REINFORCED PLASTIC MOLDING, MOLDING MATERIAL, MOLDED ARTICLE, AND PRODUCTION METHOD FOR MOLDED ARTICLE DIC CORPORATION (JP) 2021-03-04 US disclosed
US-7442553-B2 Method for determining the amount of the maleimidyl groups of a particle FUJI XEROX CO., LTD. (JP) 2008-10-28 US disclosed
EP-1331494-A1 COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND PLASTIC LENS NOF CORPORATION (JP) 2003-07-30 EP disclosed
EP-0271010-A2 Copolymers with 0-nitrocarbinol ester groups, and their use BASF Aktiengesellschaft (DE) 1988-06-15 EP disclosed
JP-S60116152-A MANUFACTURE OF SEALED HYBRID IC MATSUSHITA ELECTRIC WORKS LTD 1985-06-22 JP disclosed