SCHEMBL8049367

SCHEMBL8049367

CC(O)CCCC=Cc1ccc(-c2ncc(-c3ccc(O)cc3)cn2)cc1F

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
PDGFRB P09619 1/20 0.32
PDGFRA P16234 1/20 0.32
TYR P14679 2/20 0.30
PDE3B Q13370 1/20 0.30
PDE3A Q14432 1/20 0.30
P2RY12 Q9H244 1/20 0.30
ESR2 Q92731 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
SCHEMBL8049362 1.00 MEN1 (0.40) MEN1NPC1RAB9AKMT2APDGFRB
SCHEMBL8047218 0.92 PDE3B (0.32) PDE3BPDE3AP2RY12
SCHEMBL8047222 0.92 PDE3B (0.32) PDE3BPDE3AP2RY12
SCHEMBL8052691 0.90 MEN1 (0.32) MEN1NPC1RAB9AKMT2APDE3B
SCHEMBL8052696 0.90 MEN1 (0.32) MEN1NPC1RAB9AKMT2APDE3B
SCHEMBL8049548 0.89 KIF11 (0.36) TYRESR2
SCHEMBL8035163 0.89 KIF11 (0.36) TYRESR2
SCHEMBL8035164 0.89 KIF11 (0.36) TYRESR2
SCHEMBL8049545 0.89 KIF11 (0.36) TYRESR2
SCHEMBL8046799 0.88 HSD17B1 (0.34) NPC1RAB9APDE3BPDE3AP2RY12

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-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-6030546-A FERROELECTRIC PHASE; LOW VISCOSITY;, THERMOSENSITIVITY OVER A BROAD AND EXHIBITS A LARGE TILT ANGLE AND A HIGH-SPEED RESPONSE PROPERTY;CHEMICAL INTERMEDIATES FOR PESTICIDES, DRUGS AND LIQUID CRYSTALS; BORIDING AND HYDROLYSIS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-29 US 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