SCHEMBL8398155

SCHEMBL8398155

CCOC(OC)Oc1cc(C(O)C=Cc2ccccc2C(=O)O)ccc1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.34
FAAH O00519 4/20 0.34
HDAC11 Q96DB2 2/20 0.33
RARA P10276 5/20 0.32
RARB P10826 4/20 0.32
RARG P13631 4/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 2/20 0.32
CNR1 P21554 2/20 0.32
MEN1 O00255 1/20 0.31
NR1I2 O75469 1/20 0.31
PGR P06401 1/20 0.31
HSPD1 P10809 1/20 0.31
GOT1 P17174 1/20 0.31
GLRA1 P23415 1/20 0.31
BLM P54132 1/20 0.31
HSPE1 P61604 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
IKBKB O14920 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
SCHEMBL8394410 0.87 RARA (0.39) CNR2FAAHHDAC11RARARARB
SCHEMBL8394256 0.85 PTGER4 (0.36) CNR2FAAHHDAC11RARARARB
SCHEMBL8397766 0.82 RARA (0.46) CNR2FAAHHDAC11RARARARB
SCHEMBL8397873 0.81 CNR2 (0.35) CNR2FAAHRARARARBRARG
SCHEMBL8696047 0.80 HDAC11 (0.36) CNR2FAAHHDAC11RARARARB
SCHEMBL8397835 0.77 KDM4E (0.43) CNR2FAAHRARARARBRARG
SCHEMBL8397882 0.77 RARG (0.48) CNR2RARARARBRARGKDM4E
SCHEMBL8394296 0.77 CNR2 (0.35) CNR2FAAHRARARARBRARG
SCHEMBL8397780 0.76 RARA (0.36) CNR2FAAHRARARARBRARG
SCHEMBL8395014 0.76 FAAH (0.30) CNR2FAAHCNR1

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
US-5877342-A SKIN DISORDERS; RESPIRATORY SYSTEM DISORDERS; CARDIOVASCULAR DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUIES GALDERMA (FR) 1999-03-02 US claimed
US-5877342-A SKIN DISORDERS; RESPIRATORY SYSTEM DISORDERS; CARDIOVASCULAR DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUIES GALDERMA (FR) 1999-03-02 US disclosed