SCHEMBL28397604

SCHEMBL28397604

Cc1cccc(C)c1OP(=O)(Oc1c(C)cccc1C)OP(=O)(Oc1c(C)cccc1C)Oc1c(C)cccc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.42
LMNA P02545 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
GAA P10253 1/20 0.40
CYP3A4 P08684 3/20 0.37
TSHR P16473 2/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SCN4A P35499 4/20 0.35
CYP1A2 P05177 3/20 0.35
SCN1A P35498 2/20 0.35
SCN5A Q14524 2/20 0.35
SCN9A Q15858 2/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
NFKB1 P19838 1/20 0.35
KCNK3 O14649 1/20 0.35
CACNA1F O60840 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
SCHEMBL940949 0.91 MAPT (0.45) MAPTLMNASMN1; SMN2GAACYP3A4
Hydroquinone SCHEMBL9718342 0.90 SCN8A (0.39) MAPTLMNASMN1; SMN2GAAKDM4E
SCHEMBL2571511 0.88 INPPL1 (0.42) MAPTLMNASMN1; SMN2GAAKDM4E
Resorcinol SCHEMBL14939224 0.87 CYP3A4 (0.41) MAPTLMNASMN1; SMN2GAACYP3A4
SCHEMBL28055475 0.84 MAPT (0.41) MAPTLMNASMN1; SMN2GAACYP3A4
Phosphoric Acid SCHEMBL8344759 0.84 INPPL1 (0.42) MAPTLMNASMN1; SMN2GAACYP3A4
SCHEMBL12997457 0.84 MAPT (0.41) MAPTLMNASMN1; SMN2GAACYP3A4
SCHEMBL3757863 0.83 MAPT (0.40) MAPTLMNASMN1; SMN2GAACYP3A4
SCHEMBL4990431 0.83 MAPT (0.40) MAPTLMNASMN1; SMN2GAACYP3A4
SCHEMBL131318 0.83 CYP3A4 (0.59) MAPTLMNASMN1; SMN2GAACYP3A4

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
CN-108003771-B Halogen-free flame-retardant electromagnetic shielding material and preparation method and application thereof 杭州湘隽阻燃科技有限公司 2020-05-22 CN claimed
CN-114479400-A PC/ABS alloy material and preparation method and application thereof 中国石油化工股份有限公司 2022-05-13 CN disclosed
CN-112280027-A Phosphorus-silicon-containing copolymerized polycarbonate, preparation method and composition thereof, and preparation method and application of composition 东莞市华盈新材料有限公司 2021-01-29 CN disclosed