SCHEMBL19636674

SCHEMBL19636674

CC1CC=Cc2c1n(-c1cccc(-c3cccc(-c4ccnc(-c5cc(-c6ccccc6)ccn5)c4)c3)c1)c1ccccc21

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 4/20 0.34
▸ PRKDC P78527 2/20 0.34
▸ USP30 Q70CQ3 2/20 0.33
▸ HTR1A P08908 2/20 0.31
▸ HTR7 P34969 2/20 0.31
▸ DHFR P00374 2/20 0.31
▸ KHK P50053 1/20 0.31
▸ OPRD1 P41143 1/20 0.30
▸ PIK3R2 O00459 1/20 0.30

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
SCHEMBL22185942 0.84 KDM4E (0.34) —
SCHEMBL19636543 0.83 — —
SCHEMBL21845438 0.82 ATM (0.35) —
SCHEMBL13903725 0.81 KDM4E (0.37) —
SCHEMBL19570179 0.80 KDM4E (0.37) —
SCHEMBL25956652 0.80 KDM4E (0.40) —
SCHEMBL22415195 0.80 KDM4E (0.40) —
SCHEMBL26405993 0.79 PDE10A (0.33) —
SCHEMBL26000318 0.78 RAC2 (0.32) —
SCHEMBL19628186 0.78 ATM (0.47) GRM5PRKDCUSP30HTR1AHTR7

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
WO-2017199163-A1 LIGHT-EMITTING ELEMENT, DISPLAY DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-11-23 — — WO disclosed
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