SCHEMBL11865220

SCHEMBL11865220

Cc1ccc2c(-c3cccc4ccccc34)nc(=O)n(CC3CC3)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 2/20 0.41
▸ NR1I2 O75469 1/20 0.41
▸ EGFR P00533 1/20 0.41
▸ ADRA2A P08913 1/20 0.41
▸ ADORA3 P0DMS8 1/20 0.41
▸ TBXA2R P21731 1/20 0.41
▸ PTGS2 P35354 1/20 0.41
▸ OPRD1 P41143 1/20 0.41
▸ OPRM1 P35372 1/20 0.39
▸ MAOA P21397 1/20 0.37
▸ MAOB P27338 1/20 0.37
▸ PDE5A O76074 1/20 0.37
▸ PDE4A P27815 1/20 0.37
▸ PDE4B Q07343 1/20 0.37
▸ PDE4C Q08493 1/20 0.37
▸ BRD4 O60885 1/20 0.36
▸ CREBBP Q92793 1/20 0.36
▸ CNR2 P34972 2/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ LMNA P02545 1/20 0.36

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
SCHEMBL11857025 0.87 PDE4A (0.41) PDE4DPDE5APDE4APDE4BPDE4C
SCHEMBL11165951 0.84 NR1I2 (0.58) PDE4DNR1I2EGFRADRA2AADORA3
SCHEMBL11864694 0.80 MAPT (0.44) CNR2KDM4EALDH1A1HPGD
SCHEMBL11865026 0.80 LMNA (0.37) PDE4DPDE5APDE4APDE4BPDE4C
SCHEMBL11870097 0.79 PARG (0.38) PTGS2CNR2CNR1KCNH2
SCHEMBL11853865 0.78 GRIN1 (0.44) PDE4DNR1I2EGFRADRA2AADORA3
SCHEMBL11861502 0.78 ADORA2A (0.42) PDE4DNR1I2EGFRADRA2AADORA3
SCHEMBL11635900 0.77 LMNA (0.55) PDE4DNR1I2EGFRADRA2AADORA3
SCHEMBL11635741 0.75 NR1I2 (0.49) PDE4DNR1I2EGFRADRA2AADORA3
SCHEMBL11857345 0.73 CNR2 (0.42) CNR2CNR1LMNA

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-3950526-A Quinazoline derivatives in pharmaceutical compositions for treating pain and inflammation SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-04-13 — — US disclosed
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