SCHEMBL8070949

SCHEMBL8070949

C=CCCc1ccccc1OCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
KDM4E B2RXH2 2/20 0.42
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ATM Q13315 2/20 0.41
PPARD Q03181 1/20 0.41
HPGD P15428 1/20 0.40
CSNK1A1 P48729 1/20 0.39
CSNK1D P48730 1/20 0.39
PRKCD Q05655 1/20 0.39
PAK1 Q13153 1/20 0.39
CAMK2B Q13554 1/20 0.39
CAMK2G Q13555 1/20 0.39
CAMK2D Q13557 1/20 0.39
TAOK1 Q7L7X3 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39

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
SCHEMBL8072069 0.92 CYP1A2 (0.49) MAPTL3MBTL1NPSR1KDM4ETHRA
SCHEMBL8062361 0.90 THRA (0.46) MAPTL3MBTL1NPSR1KDM4ETHRA
SCHEMBL8072894 0.89 THRA (0.48) MAPTL3MBTL1NPSR1KDM4ETHRA
SCHEMBL22700920 0.88 KDM4E (0.53) MAPTL3MBTL1NPSR1KDM4EALDH1A1
SCHEMBL8078003 0.88 THRA (0.50) MAPTL3MBTL1NPSR1KDM4ETHRA
SCHEMBL8076259 0.88 THRA (0.50) MAPTL3MBTL1NPSR1KDM4ETHRA
SCHEMBL8072813 0.88 THRA (0.50) MAPTL3MBTL1NPSR1KDM4ETHRA
SCHEMBL8071476 0.88 THRA (0.50) MAPTL3MBTL1NPSR1KDM4ETHRA
SCHEMBL8073005 0.86 L3MBTL1 (0.51) MAPTL3MBTL1NPSR1THRATHRB
SCHEMBL8077923 0.84 THRA (0.49) MAPTL3MBTL1NPSR1KDM4ETHRA

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
US-6063940-A Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-05-16 US disclosed
US-5637736-A Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-06-10 US disclosed
EP-0637580-A1 Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-02-08 EP disclosed