SCHEMBL9761835

SCHEMBL9761835

CC(C)COCc1ccn(C)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JMJD6 Q6NYC1 1/20 0.39
EPHX2 P34913 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
OPRM1 P35372 1/20 0.35
OPRL1 P41146 1/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
GRM2 Q14416 1/20 0.34
KCNH2 Q12809 7/20 0.33
GRIN2B Q13224 3/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
KMT2A Q03164 1/20 0.32

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
SCHEMBL29306459 0.79 EPHX2 (0.39) JMJD6EPHX2NPC1RAB9AOPRM1
SCHEMBL23986458 0.78 EPHX2 (0.38) JMJD6EPHX2OPRM1OPRL1DDB1
SCHEMBL24792887 0.76 EPHX2 (0.42) JMJD6EPHX2OPRM1OPRL1DDB1
SCHEMBL9762587 0.75 EPHX2 (0.36) EPHX2OPRM1OPRL1DDB1CRBN
SCHEMBL2629338 0.75
SCHEMBL1913020 0.75 EPHX2 (0.41) JMJD6EPHX2OPRM1OPRL1DDB1
SCHEMBL17541290 0.73
Hydrochloric Acid SCHEMBL10815720 0.72 EPHX2 (0.39) EPHX2OPRM1OPRL1DDB1CRBN
SCHEMBL18355383 0.70 EPHX2 (0.38) EPHX2OPRM1OPRL1DDB1CRBN
SCHEMBL17662643 0.70 JMJD6 (0.43) JMJD6KDM4ENPC1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1045783-A Diaza  class anti-allergy medicament PFIZER (US) 1990-10-03 CN claimed
US-5008263-A Platelet activating factor antagonists; antiallergens; antiinflammatory agents PFIZER INC. (US) 1991-04-16 US disclosed
CN-1045783-A Diaza  class anti-allergy medicament PFIZER (US) 1990-10-03 CN disclosed