SCHEMBL23906401

SCHEMBL23906401

CCn1ccc2c(N)ncc(N)c21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 2/20 0.37
▸ TLR7 Q9NYK1 1/20 0.36
▸ ADORA1 P30542 1/20 0.33
▸ PI4KA P42356 1/20 0.33
▸ PI4K2B Q8TCG2 1/20 0.33
▸ PI4K2A Q9BTU6 1/20 0.33
▸ PI4KB Q9UBF8 1/20 0.33
▸ F2RL1 P55085 1/20 0.33
▸ CDK1 P06493 1/20 0.33
▸ CCNB1 P14635 1/20 0.33
▸ CCNE1 P24864 1/20 0.33
▸ CDK2 P24941 1/20 0.33
▸ F2R P25116 1/20 0.30
▸ RAB9A P51151 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
SCHEMBL22509634 0.83 F2RL1 (0.40) ADORA2ATLR7ADORA1PI4KAPI4K2B
SCHEMBL26605039 0.70 HTR2A (0.37) ADORA2API4KAPI4KBCDK1CCNB1
SCHEMBL12151781 0.70 ADORA2A (0.53) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL31359719 0.68 MAPT (0.35) ADORA2ATLR7CDK1CCNB1CCNE1
SCHEMBL26661995 0.67 MPO (0.34) F2R
SCHEMBL22071859 0.67 DYRK1A (0.37) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL27684232 0.67 ADORA2A (0.53) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL16475178 0.66 F2RL1 (0.33) F2RL1RAB9A
SCHEMBL16475117 0.63 ALDH1A1 (0.35) F2RL1
SCHEMBL28636829 0.63 NSD2 (0.37) —

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-2021202480-A1 COMPOUNDS TARGETING PRMT5 ALIGOS THERAPEUTICS, INC. (US) 2021-10-07 — — WO disclosed
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