SCHEMBL18924217

SCHEMBL18924217

Cc1cc2nc3cc(C(F)(F)F)ccc3oc-2cc1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
ALPL P05186 1/20 0.43
POLB P06746 1/20 0.43
ALPI P09923 1/20 0.43
MAPT P10636 1/20 0.43
ALPG P10696 1/20 0.43
RECQL P46063 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CYP1A1 P04798 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2E1 P05181 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C8 P10632 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2A6 P11509 1/20 0.39
CYP2C9 P11712 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
SCHEMBL7988985 0.74 L3MBTL1 (0.51) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL16069666 0.73 CETP (0.40) KDM4ECETPAGPAT2NOTUMHDAC3
SCHEMBL12952317 0.72 SNCA (0.44) KDM4EMEN1ALDH1A1ALPLPOLB
SCHEMBL327849 0.71 APP (0.63) KDM4EMEN1ALDH1A1ALPLPOLB
SCHEMBL18924199 0.69 L3MBTL1 (0.38) KDM4EMEN1ALDH1A1ALPLPOLB
SCHEMBL21130280 0.69 AKR1B1 (0.44) KDM4EMEN1POLBMAPTRAB9A
SCHEMBL16069582 0.68 AGPAT2 (0.40) KDM4EKMT2AL3MBTL1CETPAGPAT2
SCHEMBL11929993 0.68 NPC1 (0.42) KDM4ERAB9ACETPAGPAT2HDAC3
SCHEMBL20708543 0.68 MAPT (0.64) KDM4EALDH1A1POLBMAPTRAB9A
SCHEMBL19899503 0.67 HDAC3 (0.44) KDM4ERAB9AAGPAT2HDAC3HDAC1

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-9670170-B2 Resorufin derivatives for treatment of oxidative stress disorders BIOELECTRON TECHNOLOGY CORPORATION (US) 2017-06-06 US disclosed