SCHEMBL7710156

SCHEMBL7710156

CCCCC#Cc1cc[nH]c(=O)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.37
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C9 P11712 1/20 0.36
APEX1 P27695 1/20 0.36
CYP2C19 P33261 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
GRM5 P41594 1/20 0.35
PGK1 P00558 1/20 0.35
ADORA3 P0DMS8 6/20 0.35
ELANE P08246 1/20 0.34
KCNH2 Q12809 1/20 0.33
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33

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
SCHEMBL31045608 0.72 GPR84 (0.35) GPR84ADORA3ELANEKCNH2ADORA2A
SCHEMBL7714759 0.71 ADORA2A (0.36) ELANEADORA2AADORA1
SCHEMBL6746715 0.69 KCNH2 (0.42) GPR84ADORA3KCNH2
SCHEMBL9234412 0.68 GRM5 (0.47) GRM5PGK1ADORA3KCNH2ADORA2A
SCHEMBL250311 0.66
SCHEMBL26849709 0.65 GPR84 (0.40) GPR84MAPTHSD17B10ELANEKCNH2
SCHEMBL25915803 0.65 ELANE (0.48) GPR84LMNAMAPTSMN1; SMN2HSD17B10
SCHEMBL7257448 0.65 TLR8 (0.34) CYP2D6GRM5
SCHEMBL13161713 0.64 BACE1 (0.41) GPR84KDM4ELMNACYP1A2MAPT
SCHEMBL14127696 0.64 TLR7 (0.36) KDM4ELMNACYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6369040-B1 INCORPORATING A COMPLEMENTARY SEQUENCES FOR HERPES, PAPILLOMA AND OTHER VIRUSES ISIS PHARMACEUTICALS, INC. 2002-04-09 US disclosed
US-6060592-A Pyrimidine nucleoside compounds and oligonucleoside compounds containing same ISIS PHARMACEUTICALS, INC. (US) 2000-05-09 US disclosed
WO-1995024185-A1 NOVEL PYRIMIDINE NUCLEOSIDES ISIS PHARMACEUTICALS, INC. (US) 1995-09-14 WO disclosed