SCHEMBL6522247

SCHEMBL6522247

CCc1c(Br)ccc(P(=O)(O)O)c1CC

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30
CYP2C19 P33261 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPC1 O15118 1/20 0.30
POLB P06746 1/20 0.30
PTK2B Q14289 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
SCHEMBL18261805 0.80 GABRA1 (0.32) RAB9AGABRA1GABRB2CYP2C19SMN1; SMN2
SCHEMBL4423596 0.79 GABRA1 (0.42) GABRA1GABRB2
SCHEMBL107782 0.78 CYP1A2 (0.37) RAB9ACYP2C19SMN1; SMN2NPC1POLB
SCHEMBL7020614 0.78 POLB (0.38) GABRA1GABRB2CYP2C19SMN1; SMN2NPC1
SCHEMBL7882053 0.77 CYP2C19 (0.30) CYP2C19SMN1; SMN2NPC1POLBPTK2B
SCHEMBL8026516 0.77 SMN1; SMN2 (0.41) MAPTCYP2C19SMN1; SMN2NPC1POLB
SCHEMBL2031068 0.77 CYP1A2 (0.33) CYP2C19SMN1; SMN2NPC1POLBPTK2B
SCHEMBL3481927 0.76
SCHEMBL8569204 0.75 NOS3 (0.30)
SCHEMBL27649703 0.74 SRC (0.33)

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