SCHEMBL16631756

SCHEMBL16631756

CCn1cc2c(=O)cc(F)[nH]c2nc1=O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 7/20 0.34
ADORA2A P29274 6/20 0.34
LMNA P02545 1/20 0.30
CYP2C9 P11712 1/20 0.30
ATP6V1B2 P21281 1/20 0.30
TBXA2R P21731 1/20 0.30
EDNRA P25101 1/20 0.30
TARBP2 Q15633 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
SCHEMBL16631765 0.86 NPSR1 (0.33) ADORA1ADORA2A
SCHEMBL18081961 0.80 ADORA1 (0.35) ADORA1ADORA2A
SCHEMBL16631558 0.78 SMN1; SMN2 (0.32) LMNA
SCHEMBL16631758 0.77 LMNA (0.30) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL16631772 0.75 KMT2A (0.32) LMNA
SCHEMBL16631753 0.73 ADORA2A (0.49) ADORA1ADORA2ALMNA
SCHEMBL16631774 0.72 MEN1 (0.33) LMNA
SCHEMBL16631683 0.70 MEN1 (0.30) LMNA
SCHEMBL16631599 0.65
SCHEMBL16631681 0.65 KDM4E (0.42) ADORA1ADORA2ALMNACYP2C9

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-2015051173-A2 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC (US) 2015-04-09 WO disclosed