SCHEMBL19936551

SCHEMBL19936551

CCn1nc(-c2ccc(C)cc2C)cc1NC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 1/20 0.38
▸ GAA P10253 1/20 0.36
▸ ALPL P05186 2/20 0.35
▸ CRHR1 P34998 3/20 0.35
▸ TGFBR1 P36897 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ MAPT P10636 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ LMNA P02545 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ MAPK10 P53779 1/20 0.34
▸ HTR2C P28335 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ TP53 P04637 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ HTT P42858 1/20 0.31
▸ NR3C1 P04150 1/20 0.31

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
SCHEMBL10049093 0.77 CRHR1 (0.38) TLR8ALPLCRHR1CA9MAPT
SCHEMBL3436157 0.74 CA9 (0.48) ALPLCA9MAPTMEN1KMT2A
SCHEMBL2689279 0.67 CYP2A6 (0.51) MAPTALDH1A1
SCHEMBL11962891 0.66 CYP3A4 (0.46) TLR8GAAALPLCRHR1CA9
SCHEMBL25835823 0.65 GAA (0.38) GAAMAPTALDH1A1
SCHEMBL21236592 0.65 LMNA (0.36) TGFBR1MAPTMEN1KMT2ALMNA
SCHEMBL3448871 0.64 KMT2A (0.42) TLR8GAAALPLCRHR1CA9
SCHEMBL19936669 0.64 ACHE (0.40) GAACRHR1MAPTMEN1KMT2A
SCHEMBL19121993 0.64 MAPT (0.39) TLR8GAAALPLCRHR1CA9
SCHEMBL24732287 0.63 CCR1 (0.64) TLR8GAAALPLCA9MAPT

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
EP-2594555-B1 HETEROCYCLIC COMPOUND, AND p27 KIP1 DEGRADATION INHIBITOR ASKA PHARM CO LTD (JP) 2018-03-07 — — EP disclosed
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