SCHEMBL29138960

SCHEMBL29138960

CC(C)(C)c1cc(O)cc(C(C)(C)C)c1OP(=O)(O)Oc1c(C(C)(C)C)cc(O)cc1C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
ALOX15 P16050 3/20 0.39
NR1I2 O75469 2/20 0.39
TYR P14679 2/20 0.39
LMNA P02545 2/20 0.39
CYP2C9 P11712 1/20 0.39
MIF P14174 1/20 0.39
HTT P42858 1/20 0.39
NFE2L2 Q16236 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
CYP1A2 P05177 2/20 0.37
MAPT P10636 1/20 0.37
ATP2A2 P16615 1/20 0.37
ATP2A3 Q93084 1/20 0.37
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
CA2 P00918 3/20 0.34
CA1 P00915 2/20 0.34

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
SCHEMBL29145019 0.89 INPPL1 (0.42) ALDH1A1ALOX15NR1I2TYRLMNA
SCHEMBL8927511 0.85 GABRA1 (0.35) ALDH1A1ALOX15HTTKDM4ESMN1; SMN2
SCHEMBL28340006 0.78 CA2 (0.45) ALDH1A1GABRA1GABRB2CA2TSHR
SCHEMBL27659646 0.78 HMGCR (0.35) ALDH1A1ALOX15NR1I2LMNACYP2C9
SCHEMBL28263409 0.77 SRC (0.38) LMNACYP2C9CYP1A2GABRA1GABRB2
SCHEMBL219967 0.74 ALDH1A1 (0.38) ALDH1A1CYP1A2GABRA1GABRB2CA2
SCHEMBL8480850 0.73 SRC (0.53) ALDH1A1TYRCYP2C9SMN1; SMN2CA2
SCHEMBL5862960 0.73 CA2 (0.57) ALDH1A1ALOX15NR1I2TYRLMNA
Resorcinol SCHEMBL21708824 0.73 CA2 (0.37) ALDH1A1ALOX15NR1I2TYRLMNA
SCHEMBL3157771 0.73 TDP1 (0.52) ALDH1A1ALOX15NR1I2TYRLMNA

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
CN-116789883-B Polyolefin elastomer and application thereof in photovoltaic packaging film 万华化学集团股份有限公司 2024-01-09 CN claimed
CN-116789883-A Polyolefin elastomer and application thereof in photovoltaic packaging film 万华化学集团股份有限公司 2023-09-22 CN claimed
CN-116789883-B Polyolefin elastomer and application thereof in photovoltaic packaging film 万华化学集团股份有限公司 2024-01-09 CN disclosed
CN-117210143-A EVA adhesive film with high body resistance and low cost and preparation method thereof 山东慕尔斯新材料科技有限公司 2023-12-12 CN disclosed
CN-116789883-A Polyolefin elastomer and application thereof in photovoltaic packaging film 万华化学集团股份有限公司 2023-09-22 CN disclosed