SCHEMBL8035643

SCHEMBL8035643

CC(O)CCCC=Cc1cnc2cc(O)ccc2n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 1/20 0.35
TYR P14679 2/20 0.34
MAPT P10636 3/20 0.34
ALDH1A1 P00352 2/20 0.34
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
P2RY12 Q9H244 1/20 0.33
PPARG P37231 1/20 0.33
NCOA2 Q15596 1/20 0.33
NCOA1 Q15788 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
RAB9A P51151 1/20 0.33
ESR2 Q92731 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.30
ALOX12 P18054 1/20 0.30
MAPK10 P53779 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
SCHEMBL8035639 1.00 LTB4R (0.35) LTB4RTYRMAPTALDH1A1PDE3B
SCHEMBL8047065 0.91 ESR2 (0.34) LTB4RMAPTALDH1A1PDE3BPDE3A
SCHEMBL8047073 0.91 ESR2 (0.34) LTB4RMAPTALDH1A1PDE3BPDE3A
SCHEMBL8045668 0.87 JAK1 (0.38) PDE3BPDE3AP2RY12ESR2
SCHEMBL8045671 0.87 JAK1 (0.38) PDE3BPDE3AP2RY12ESR2
SCHEMBL8036653 0.83 ALDH1A1 (0.33) LTB4RMAPTALDH1A1PDE3BPDE3A
SCHEMBL8036646 0.83 ALDH1A1 (0.33) LTB4RMAPTALDH1A1PDE3BPDE3A
SCHEMBL8044855 0.82 JAK1 (0.35) LTB4RPDE3BPDE3AP2RY12ESR2
SCHEMBL8044853 0.82 JAK1 (0.35) LTB4RPDE3BPDE3AP2RY12ESR2
SCHEMBL8044088 0.82 PFKFB3 (0.46) LTB4RTYRMAPTALDH1A1PDE3B

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