SCHEMBL9261373

SCHEMBL9261373

Cc1ccc(-c2nc3n(C)c4ccccc4n3c2CC(=O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.47
▸ POLB P06746 2/20 0.47
▸ ADORA1 P30542 3/20 0.43
▸ ADORA2B P29275 1/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ PTGDR2 Q9Y5Y4 4/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ GFER P55789 1/20 0.41
▸ RAB9A P51151 1/20 0.40
▸ AURKA O14965 1/20 0.40
▸ KDR P35968 1/20 0.40
▸ AURKB Q96GD4 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ ADAMTS5 Q9UNA0 1/20 0.39
▸ RXRA P19793 1/20 0.39
▸ RXRB P28702 1/20 0.39

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
SCHEMBL9261565 0.88 LMNA (0.48) LMNAPOLBADORA1ADORA2BMEN1
SCHEMBL9267445 0.87 ADORA1 (0.41) LMNAPOLBADORA1ADORA2BKMT2A
SCHEMBL9263087 0.87 GABRA1 (0.54) LMNAPOLBADORA1ADORA2BKDM4E
SCHEMBL9256941 0.86 LMNA (0.46) LMNAPOLBMEN1KMT2APTGDR2
SCHEMBL9261346 0.83 PTGDR2 (0.45) LMNAPOLBADORA1MEN1KMT2A
SCHEMBL9261406 0.80 KDM4E (0.43) LMNAPOLBADORA1ADORA2BMEN1
SCHEMBL9262280 0.80 KDM4E (0.46) ADORA1ADORA2BPTGDR2KDM4EMAPT
SCHEMBL9265830 0.79 ALDH1A1 (0.41) LMNAPOLBADORA1ADORA2BMEN1
SCHEMBL9262785 0.78 PTGER1 (0.39) LMNAPOLBADORA1ADORA2BMEN1
SCHEMBL9264676 0.78 GABRA1 (0.46) LMNAPOLBMEN1KMT2AKDM4E

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-5466706-A Compounds for hypnotics, anxiety or anticonvulsants SYNTHELABO (FR) 1995-11-14 — — US disclosed
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