SCHEMBL7612924

SCHEMBL7612924

CCCC(C)CN(CC(C)CCC)c1ccccc1F

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.35
ESR1 P03372 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PER2 O15055 1/20 0.32
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
POLB P06746 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
GPR88 Q9GZN0 1/20 0.30
MC4R P32245 3/20 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
SCHEMBL5716451 0.87 TAS1R3 (0.31) TAS1R3TAS1R1
SCHEMBL5716294 0.81 MC4R (0.31) ALDH1A1MC4R
SCHEMBL9281558 0.78 ESR1 (0.40) TAAR1ESR1L3MBTL1KMT2ATDP1
SCHEMBL5716526 0.76 UBE2M (0.32) TAS1R3TAS1R1GPR88
SCHEMBL7125671 0.75 TAAR1 (0.37) TAAR1ESR1SMN1; SMN2PER2KMT2A
SCHEMBL6791387 0.74 PSEN1 (0.37) ALDH1A1HPGDMC4R
SCHEMBL10620529 0.74 ESR1 (0.47) TAAR1ESR1KMT2ATDP1ALDH1A1
SCHEMBL1490146 0.73 LMNA (0.41) TAAR1ESR1SMN1; SMN2KMT2AALDH1A1
SCHEMBL5716050 0.72 ALDH1A1 (0.32) ALDH1A1
SCHEMBL5716258 0.72 TSHR (0.38) SMN1; SMN2POLBALDH1A1GPR88

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1252166-A1 OLEFIN POLYMERIZATION COCATALYSTS DERIVED FROM GROUP-15 CATIONIC COMPOUNDS AND PROCESSES USING THEM EXXON CHEMICAL PATENTS INC. (US) 2002-10-30 EP disclosed
WO-2001042249-A1 OLEFIN POLYMERIZATION COCATALYSTS DERIVED FROM GROUP-15 COMPOUNDS AND PROCESSES USING THEM EXXON CHEMICAL PATENTS INC. (US) 2001-06-14 WO disclosed