SCHEMBL5399445

SCHEMBL5399445

Cc1ccc2sc(C)c(C3=C(c4c(C)sc5ccc(C)cc45)CCC3)c2c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.33
▸ TP53 P04637 1/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ ACHE P22303 3/20 0.33
▸ BCHE P06276 2/20 0.33
▸ GRIN1 Q05586 2/20 0.33
▸ GRIN2A Q12879 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ IDO1 P14902 2/20 0.32
▸ PTGES O14684 1/20 0.32
▸ GAA P10253 1/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ CASP7 P55210 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ CYP2A6 P11509 1/20 0.31
▸ POLB P06746 2/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ PTGS2 P35354 1/20 0.30

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
SCHEMBL5054625 0.79 GPR3 (0.41) MAPTTP53KDM4EALDH1A1LMNA
SCHEMBL14522095 0.72 PLA2G10 (0.36) MAPTKDM4EALDH1A1LMNAHPGD
SCHEMBL2614668 0.71 IDO1 (0.37) MAPTIDO1CYP2A6L3MBTL1RAB9A
SCHEMBL1609993 0.70 CYP2A6 (0.42) MAPTKDM4EACHEALDH1A1HPGD
SCHEMBL17339892 0.68 IDO1 (0.45) MAPTTP53ACHEIDO1CYP2A6
SCHEMBL825667 0.66 CYP2A6 (0.39) MAPTKDM4EALDH1A1HPGDIDO1
SCHEMBL16785723 0.66 PIM1 (0.42) MAPTKDM4EACHEALDH1A1HPGD
SCHEMBL13889738 0.66 MEN1 (0.39) MAPTTP53KDM4EALDH1A1LMNA
SCHEMBL5384092 0.66 CYP2A6 (0.35) KDM4EALDH1A1LMNAHPGDCYP2A6
SCHEMBL26837126 0.66 ACHE (0.40) MAPTTP53KDM4EACHEBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7297751-B2 Photocontrolled photochromic electroluminescent and electroconductive polymers for photonics SAMSUNG ELECTRONICS CO., LTD. (KR) 2007-11-20 — — US disclosed
US-20060091364-A1 Photocontrolled photochromic electroluminescent and electroconductive polymers for photonics SAMSUNG DISPLAY CO., LTD. (KR) 2006-05-04 — — US disclosed
Send feedback