SCHEMBL25950231

SCHEMBL25950231

COCCOCC(C)(COCC(F)(F)C(F)(F)F)COC(=O)c1ccc(N)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.42
LMNA P02545 3/20 0.42
CYP1A2 P05177 3/20 0.42
MAOA P21397 2/20 0.42
TSHR P16473 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
PDE4D Q08499 1/20 0.41
PHLPP2 Q6ZVD8 1/20 0.40
MAPT P10636 4/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
ALDH1A1 P00352 1/20 0.40
ABCB11 O95342 1/20 0.39
ADRA2B P18089 1/20 0.39
OPRD1 P41143 1/20 0.39
SCN5A Q14524 1/20 0.39
CYP2D6 P10635 2/20 0.39
HTR3A P46098 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39

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
SCHEMBL25950164 0.91 LMNA (0.45) CYP3A4LMNACYP1A2MAOATSHR
SCHEMBL25950210 0.85 LMNA (0.46) CYP3A4LMNACYP1A2MAOATSHR
SCHEMBL25950158 0.84 LMNA (0.45) CYP3A4LMNACYP1A2MAOATSHR
SCHEMBL25950171 0.82 ADRB2 (0.37) CYP3A4LMNACYP1A2MAOATSHR
SCHEMBL25950207 0.81 TDP1 (0.40) MAPTNPC1RAB9AALDH1A1ADRB2
SCHEMBL17308098 0.79 LMNA (0.49) CYP3A4LMNACYP1A2MAOATSHR
SCHEMBL25950132 0.77 LMNA (0.54) CYP3A4LMNACYP1A2MAOATSHR
SCHEMBL22560132 0.77 LMNA (0.45) CYP3A4LMNACYP1A2MAOATSHR
SCHEMBL25950203 0.77 LMNA (0.40) CYP3A4LMNACYP1A2MAOATSHR
SCHEMBL25950153 0.76 LMNA (0.39) CYP3A4LMNACYP1A2MAOATSHR

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11725079-B2 Polyimide compositions and articles incorporating the same THE BOEING COMPANY (US) 2023-08-15 US disclosed