SCHEMBL8047671

SCHEMBL8047671

C=CCc1ccc(-c2ccc(-c3ccc(C=CCCCC(C)OCCCCC)cc3)nn2)cc1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 3/20 0.35
RAB9A P51151 3/20 0.35
NPC1 O15118 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CASP3 P42574 2/20 0.35
SENP8 Q96LD8 2/20 0.35
SENP7 Q9BQF6 2/20 0.35
SENP6 Q9GZR1 2/20 0.35
TNNC1 P63316 1/20 0.35
CNR2 P34972 2/20 0.34
CNR1 P21554 1/20 0.32
TRPM8 Q7Z2W7 3/20 0.32
MITF O75030 1/20 0.31
KLF5 Q13887 1/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL8047664 1.00 KDM4E (0.35) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL8048851 0.92 TNNC1 (0.38) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL8048845 0.92 TNNC1 (0.38) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL8036986 0.92 TNNC1 (0.38) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL8036987 0.92 TNNC1 (0.38) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL8225860 0.91 TNNC1 (0.30) TNNC1
SCHEMBL8225855 0.91 TNNC1 (0.30) TNNC1
SCHEMBL8047554 0.91 SMN1; SMN2 (0.41) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL8036506 0.91 CNR2 (0.34) RAB9ACASP3SENP8SENP7SENP6
SCHEMBL8048589 0.91 RAB9A (0.39) KDM4EALDH1A1HPGDRAB9ANPC1

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
EP-0643119-B1 Trans-olefin compounds, method for production thereof, liquid crystal composition containing the same as active ingredient, and liquid crystal element using said composition SUMITOMO CHEMICAL CO (JP) 2000-04-26 EP disclosed
US-5707547-A CONTAINING FLUORINATED BENZENE OR NAPHTHALENE RINGS AND/OR NITROGEN CONTAINING HETEROCYCLES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-01-13 US disclosed
EP-0643119-A1 Trans-olefin compounds, method for production thereof, liquid crystal composition containing the same as active ingredient, and liquid crystal element using said composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-03-15 EP disclosed