SCHEMBL9450233

SCHEMBL9450233

CCOC(=O)c1ccc(-c2ccc(OCCCCCCCCCCCCBr)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.62
HRH3 Q9Y5N1 1/20 0.62
RARB P10826 3/20 0.57
TDP1 Q9NUW8 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
DHFR P00374 1/20 0.54
TBXAS1 P24557 1/20 0.52
GAA P10253 1/20 0.51
LMNA P02545 1/20 0.51
SCN1A P35498 1/20 0.51
SCN2A Q99250 1/20 0.51
SCN3A Q9NY46 1/20 0.51
HTT P42858 1/20 0.50
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPT P10636 1/20 0.50

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
SCHEMBL10408395 1.00 KCNH2 (0.62) KCNH2HRH3RARBTDP1L3MBTL1
SCHEMBL10409033 1.00 KCNH2 (0.62) KCNH2HRH3RARBTDP1L3MBTL1
SCHEMBL11546943 0.96 L3MBTL1 (0.59) KCNH2HRH3TDP1L3MBTL1TBXAS1
SCHEMBL8942511 0.96 L3MBTL1 (0.59) KCNH2HRH3TDP1L3MBTL1TBXAS1
SCHEMBL7042805 0.96 L3MBTL1 (0.59) KCNH2HRH3TDP1L3MBTL1TBXAS1
SCHEMBL9794827 0.91 L3MBTL1 (0.61) KCNH2HRH3TDP1L3MBTL1TBXAS1
SCHEMBL8533567 0.90 RARB (0.71) KCNH2HRH3RARBTDP1L3MBTL1
SCHEMBL5351127 0.90 RARB (0.71) KCNH2HRH3RARBTDP1L3MBTL1
SCHEMBL8181561 0.90 RARB (0.71) KCNH2HRH3RARBTDP1L3MBTL1
SCHEMBL8640140 0.89 KCNH2 (0.62) KCNH2HRH3RARBTDP1L3MBTL1

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
US-5187298-A Enantiotropic, ferroelectric smectic liquid crystal polymers; two thermodynamically stable phases; polyacrylates BASF AKTIENGESELLSCHAFT (DE) 1993-02-16 US disclosed
US-5187248-A Ferroelectric smectic liquid crystal behavior BASF AKTIENGESELLSCHAFT (DE) 1993-02-16 US disclosed
US-4913839-A USABLE AT ROOM TEMPERATURE; FAST RESPONSE SPEED; DISPLAYING MOTION PICTURES; SUITABLE FOR LARGE OR CURVED SCREENS IDEMITSU KOSAN CO., LTD. (JP) 1990-04-03 US disclosed
US-4844835-A FAST RESPONSE, DISPLAYING MOTION PICTURES IDENITSU KOSAN CO., LTD. (JP) 1989-07-04 US disclosed