SCHEMBL6520699

SCHEMBL6520699

Brc1cccc(C=Cc2ccc(C=Cc3ccccc3)cc2Br)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.59
MTOR P42345 1/20 0.59
APP P05067 4/20 0.49
HSD17B3 P37058 1/20 0.46
BACE1 P56817 1/20 0.44
ALDH1A1 P00352 2/20 0.44
MAOA P21397 2/20 0.43
MAOB P27338 2/20 0.43
NFE2L2 Q16236 1/20 0.43
CYP19A1 P11511 1/20 0.43
RELA Q04206 1/20 0.43
MAPT P10636 1/20 0.42
CHRNA7 P36544 1/20 0.42
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
TUBA1B P68363 1/20 0.41
TUBA4A P68366 1/20 0.41
TUBB4B P68371 1/20 0.41
TUBB3 Q13509 1/20 0.41

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
SCHEMBL9914785 0.91 NPC1 (0.69) NPC1MTORAPPMAOAMAOB
SCHEMBL699998 0.85 HSD17B3 (0.59) HSD17B3BACE1ALDH1A1MAOAMAOB
SCHEMBL699999 0.85 HSD17B3 (0.59) HSD17B3BACE1ALDH1A1MAOAMAOB
SCHEMBL699516 0.84 HSD17B3 (0.50) NPC1MTORHSD17B3BACE1ALDH1A1
SCHEMBL699515 0.84 HSD17B3 (0.50) NPC1MTORHSD17B3BACE1ALDH1A1
SCHEMBL8902434 0.84 HSD17B3 (0.50) NPC1MTORHSD17B3BACE1ALDH1A1
SCHEMBL699610 0.79 HSD17B3 (0.57) HSD17B3BACE1ALDH1A1MAOAMAOB
SCHEMBL8900696 0.79 HSD17B3 (0.57) HSD17B3BACE1ALDH1A1MAOAMAOB
SCHEMBL699611 0.79 HSD17B3 (0.57) HSD17B3BACE1ALDH1A1MAOAMAOB
SCHEMBL709614 0.79 HSD17B3 (0.65) HSD17B3BACE1ALDH1A1MAOAMAOB

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
EP-1155096-B1 FLUORENE COPOLYMERS AND DEVICES MADE THEREFROM DOW GLOBAL TECHNOLOGIES INC (US) 2005-03-09 EP disclosed
US-6353083-B1 CONJUGATED COPOLYMER COMPRISING UNITS DERIVED FROM 9-SUBSTITUTED FLUORENE MONOMERS AND/OR 9,9-DISUBSTITUTED FLUORENE MONOMERS AND TWO DISTINCT RESIDUAL MONOMERIC UNITS THAT HAVE HOLE TRANSPORTING PROPERTIES THE DOW CHEMICAL COMPANY 2002-03-05 US disclosed
EP-1155096-A1 FLUORENE COPOLYMERS AND DEVICES MADE THEREFROM THE DOW CHEMICAL COMPANY (US) 2001-11-21 EP disclosed
WO-2000046321-A1 FLUORENE COPOLYMERS AND DEVICES MADE THEREFROM THE DOW CHEMICAL COMPANY (US) 2000-08-10 WO disclosed