SCHEMBL29636737

SCHEMBL29636737

CC(C)c1ccccc1OP(Oc1ccccc1C(C)C)Oc1ccccc1C(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.43
GABRB2 P47870 2/20 0.43
P2RX3 P56373 1/20 0.41
P2RX2 Q9UBL9 1/20 0.41
KMT2A Q03164 3/20 0.40
CYP1A2 P05177 3/20 0.40
CYP3A4 P08684 2/20 0.40
NISCH Q9Y2I1 2/20 0.40
MEN1 O00255 2/20 0.40
CYP2C19 P33261 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
CYP2C9 P11712 1/20 0.40
RECQL P46063 1/20 0.40
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
LMNA P02545 3/20 0.39
TSHR P16473 2/20 0.39
SLC6A2 P23975 2/20 0.39
FAAH O00519 1/20 0.39

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
SCHEMBL2861909 1.00 GABRA1 (0.43) GABRA1GABRB2P2RX3P2RX2KMT2A
SCHEMBL2603176 0.92 KMT2A (0.41) GABRA1GABRB2P2RX3P2RX2KMT2A
SCHEMBL6161763 0.90 KMT2A (0.42) GABRA1GABRB2P2RX3P2RX2KMT2A
SCHEMBL11117448 0.90 KMT2A (0.42) GABRA1GABRB2P2RX3P2RX2KMT2A
SCHEMBL13839494 0.86 ELANE (0.44) GABRA1GABRB2KMT2ACYP1A2MEN1
SCHEMBL13839469 0.86 P2RX3 (0.37) GABRA1GABRB2P2RX3P2RX2KMT2A
SCHEMBL8060858 0.83 GABRA1 (0.45) GABRA1GABRB2P2RX3P2RX2KMT2A
SCHEMBL4626414 0.83 GABRA1 (0.40) GABRA1GABRB2P2RX3P2RX2KMT2A
SCHEMBL500249 0.81 GABRA1 (0.40) GABRA1GABRB2P2RX3P2RX2KMT2A
SCHEMBL31090216 0.81 GABRA1 (0.40) GABRA1GABRB2P2RX3P2RX2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115210340-B Flame retardant composition for styrene resin foam, flame retardant styrene resin foam composition, and extrusion molded foam thereof 第一工业制药株式会社 2024-04-05 CN disclosed
CN-112384552-B Polyphenylene ether, curable composition containing polyphenylene ether, dry film, prepreg, cured product, laminate, and electronic component 太阳控股株式会社 2024-01-30 CN disclosed
CN-115210340-A Flame retardant composition for expanded styrene resin, flame-retardant expanded styrene resin composition, and extruded foam molded article thereof 第一工业制药株式会社 2022-10-18 CN disclosed
CN-114502652-A Curable composition containing polyphenylene ether, dry film, preform, cured product, laminate, and electronic component 太阳控股株式会社 2022-05-13 CN disclosed