SCHEMBL20003203

SCHEMBL20003203

C=C(C)C(=O)Oc1ccc(-c2ccc(-c3ccc(CC)cc3)c(F)c2)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.39
AKR1C3 P42330 2/20 0.38
AKR1C2 P52895 2/20 0.38
APP P05067 1/20 0.38
CYP2C19 P33261 1/20 0.38
FAAH O00519 2/20 0.37
PTGS2 P35354 1/20 0.37
ELANE P08246 1/20 0.37
GRM2 Q14416 1/20 0.37
S1PR1 P21453 2/20 0.36
S1PR3 Q99500 2/20 0.36
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
DGAT1 O75907 1/20 0.34
SOAT1 P35610 1/20 0.34
FFAR4 Q5NUL3 2/20 0.34

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
SCHEMBL19882279 0.93 ELANE (0.40) RARBAKR1C3AKR1C2APPCYP2C19
SCHEMBL25943727 0.90 ELANE (0.46) AKR1C3AKR1C2APPCYP2C19ELANE
SCHEMBL26144160 0.88 ELANE (0.43) AKR1C3AKR1C2APPCYP2C19PTGS2
SCHEMBL19998341 0.88 MAOB (0.38) RARBAKR1C3AKR1C2APPCYP2C19
SCHEMBL9607902 0.87 ELANE (0.48) AKR1C3AKR1C2APPCYP2C19PTGS2
SCHEMBL17484462 0.86 RARB (0.42) RARBAPPCYP2C19PTGS2ELANE
SCHEMBL15357798 0.86 RARB (0.53) RARBFAAHPTGS2S1PR1S1PR3
SCHEMBL9607894 0.86 ELANE (0.47) AKR1C3AKR1C2APPCYP2C19PTGS2
SCHEMBL15338987 0.85 BACE1 (0.41) AKR1C3AKR1C2APPCYP2C19ELANE
SCHEMBL1098577 0.85 ELANE (0.40) AKR1C3AKR1C2APPCYP2C19ELANE

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-10948780-B2 Liquid crystal element and method of producing the same JSR CORPORATION (JP) 2021-03-16 US disclosed
US-20180086978-A1 LIQUID CRYSTAL ELEMENT AND METHOD OF PRODUCING THE SAME JSR CORPORATION (JP) 2018-03-29 US disclosed