SCHEMBL30497352

SCHEMBL30497352

CC(C)c1cccc(C(C)C)c1-c1c(-c2ccccc2)ccc(P(O)O)c1-c1c(C(C)C)cccc1C(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.36
GABRG2 P18507 2/20 0.36
GABRB3 P28472 2/20 0.36
GABRB2 P47870 2/20 0.35
LMNA P02545 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
FAAH O00519 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
GABRB1 P18505 1/20 0.35
PTGS1 P23219 1/20 0.35
SLC6A2 P23975 1/20 0.35
HTR2C P28335 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
HTR2B P41595 1/20 0.35
GABRA2 P47869 1/20 0.35

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
SCHEMBL30497327 0.77 LMNA (0.36) LMNACYP1A2HPGDTSHRPTGS1
SCHEMBL29459446 0.76 CA2 (0.35) GABRA1GABRB2CA2TSHRPTPN5
SCHEMBL11314594 0.75 CA1 (0.43) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL1904397 0.72 CYP2D6 (0.34) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL15940114 0.72 MAOA (0.41) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL5952922 0.72 CYP2D6 (0.33) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL2679731 0.71 ALDH1A1 (0.41) LMNAHPGD
SCHEMBL11326822 0.71 GCGR (0.37) GABRA1GABRB2LMNACA1CA2
SCHEMBL15833732 0.70 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
Phosphoric Acid SCHEMBL28235492 0.70 PTPN5 (0.50) GABRA1GABRG2GABRB3GABRB2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113383035-B Molding material comprising carbon fiber-reinforced polycarbonate resin composition 帝人株式会社 2023-08-01 CN disclosed