SCHEMBL4894768

SCHEMBL4894768

[c]1ccc(-c2cccc(-c3cc[c]cn3)n2)nc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 4/20 0.48
CCR8 P51685 4/20 0.48
CCR5 P51681 3/20 0.48
KDM4E B2RXH2 3/20 0.48
LMNA P02545 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
TP53 P04637 1/20 0.48
ALPL P05186 1/20 0.48
HSP90AA1 P07900 1/20 0.48
ALPI P09923 1/20 0.48
ALPG P10696 1/20 0.48
ALOX15 P16050 1/20 0.48
MAPK1 P28482 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
RAB9A P51151 1/20 0.36
POLB P06746 2/20 0.33

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
SCHEMBL196791 0.85 KDM4E (0.30) CCR1CCR8CCR5KDM4ELMNA
SCHEMBL18422049 0.83 CTSS (0.42) CCR1CCR8CCR5KDM4ELMNA
SCHEMBL1047005 0.80 KDM4E (0.61) CCR1CCR8CCR5KDM4ELMNA
SCHEMBL2753257 0.74
SCHEMBL2753948 0.74 HTR7 (0.36) CYP1A2ALDH1A1
SCHEMBL2753969 0.74 ALOX5AP (0.32)
SCHEMBL17625992 0.72 ENPP3 (0.40) KDM4ETDP1L3MBTL1TP53ALOX15
SCHEMBL2753443 0.71 KDM4E (0.39) KDM4EHTTALDH1A1
SCHEMBL27914647 0.70 TP53 (0.67) CCR1CCR8CCR5KDM4ELMNA
SCHEMBL6374850 0.69 NPC1 (0.46) KDM4ELMNAMEN1KMT2ARAB9A

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-20080166591-A1 CARBAZOLE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME CANON KABUSHIKI KAISHA (JP) 2008-07-10 US disclosed