SCHEMBL30002480

SCHEMBL30002480

COc1cnc2c(COc3cc(N)c(F)cc3OC)cccc2c1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.38
CSF1R P07333 2/20 0.38
NTRK1 P04629 1/20 0.38
NTRK3 Q16288 1/20 0.38
NTRK2 Q16620 1/20 0.38
PIK3CD O00329 2/20 0.36
PDGFRB P09619 1/20 0.36
PDGFRA P16234 1/20 0.36
HPGDS O60760 1/20 0.35
DHFR P00374 2/20 0.35
ABCB1 P08183 1/20 0.35
PARP10 Q53GL7 2/20 0.35
MPO P05164 1/20 0.35
PARP15 Q460N3 1/20 0.35
PARP14 Q460N5 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
DCPS Q96C86 1/20 0.34

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
SCHEMBL30002400 0.89 KDM4E (0.39) PDE10ACSF1RPIK3CDHPGDSMPO
SCHEMBL28892709 0.89 KDM4E (0.39) PDE10ACSF1RPIK3CDHPGDSMPO
SCHEMBL30002600 0.83 HTR1A (0.41) ALDH1A1LMNAHPGD
SCHEMBL28892764 0.83 HTR1A (0.41) ALDH1A1LMNAHPGD
SCHEMBL30002661 0.81 MTNR1A (0.43) PDE10AMPO
SCHEMBL30002421 0.81 MEN1 (0.47) PDE10ACSF1RALDH1A1
SCHEMBL28892235 0.80 HTR2A (0.44) PDE10ACSF1RMPOALDH1A1
SCHEMBL30002031 0.78 DHFR (0.38) CSF1RDHFRPARP10MPOPARP15
SCHEMBL28892526 0.78 SCN1A (0.47) PDE10APARP10MPOPARP15
SCHEMBL30002548 0.78 SCN1A (0.47) PDE10APARP10MPOPARP15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115232144-B Nitrogen-containing condensed ring derivative, pharmaceutical composition, and preparation method and application thereof 长春金赛药业有限责任公司 2024-04-02 CN disclosed
CN-115232144-A Nitrogen-containing fused ring derivative, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2022-10-25 CN disclosed