SCHEMBL8204686

SCHEMBL8204686

CCC1(c2cccc(Br)c2)NC1(CC)c1cccc(Br)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
MAPK1 P28482 1/20 0.39
KDM1A O60341 1/20 0.38
RCOR1 Q9UKL0 1/20 0.38
CHRNA1 P02708 1/20 0.38
CHRNG P07510 1/20 0.38
CHRNB1 P11230 1/20 0.38
CHRNB2 P17787 1/20 0.38
SLC6A2 P23975 1/20 0.38
CHRNB4 P30926 1/20 0.38
SLC6A4 P31645 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA4 P43681 1/20 0.38
SLC6A3 Q01959 1/20 0.38
CHRND Q07001 1/20 0.38
GAA P10253 2/20 0.35
HCAR3 P49019 1/20 0.35
HCAR2 Q8TDS4 1/20 0.35
TAAR1 Q96RJ0 3/20 0.34
CYP1A2 P05177 2/20 0.34

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
SCHEMBL29858313 0.74 MMP2 (0.54) KDM1ARCOR1HCAR3HCAR2CYP1A2
SCHEMBL8402532 0.73 KDM1A (0.41) ALDH1A1MAPK1KDM1ARCOR1CHRNA1
SCHEMBL18091644 0.69 KDM1A (0.36) ALDH1A1MAPK1KDM1ARCOR1CHRNA1
SCHEMBL18091542 0.69 KDM1A (0.36) ALDH1A1MAPK1KDM1ARCOR1CHRNA1
SCHEMBL18091541 0.69 KDM1A (0.36) ALDH1A1MAPK1KDM1ARCOR1CHRNA1
SCHEMBL8210187 0.69 ALOX15 (0.34) ALDH1A1MAPK1L3MBTL1
SCHEMBL14004410 0.69 ALDH1A1 (0.48) ALDH1A1SLC6A2SLC6A4SLC6A3GAA
SCHEMBL3280576 0.69 CHRNA1 (0.41) ALDH1A1MAPK1KDM1ARCOR1CHRNA1
SCHEMBL28239960 0.67 ALDH1A1 (0.44) ALDH1A1MAPK1CHRNA1CHRNGCHRNB1
SCHEMBL8204305 0.67 SLC6A4 (0.44) SLC6A2SLC6A4SLC6A3CYP1A2CYP2C19

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-6093851-A N-(α-alkylbenzylidene)-α-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2000-07-25 US disclosed
EP-0735018-B1 N-(alpha-alkylbenzylidene)-alpha-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL CO (JP) 1999-07-21 EP disclosed
US-5739401-A N-(α-alkylbenzylidene)-α-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-04-14 US disclosed
EP-0735018-A1 N-(alpha-alkylbenzylidene)-alpha-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-10-02 EP disclosed