SCHEMBL27814960

SCHEMBL27814960

Brc1ccc(Cc2nc(-c3cc(Br)c(Br)cc3Br)c[nH]2)c(Br)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 1/20 0.33
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ CCNB2 O95067 2/20 0.31
▸ CDK1 P06493 2/20 0.31
▸ CCNB1 P14635 2/20 0.31
▸ PRKACA P17612 2/20 0.31
▸ PRKACG P22612 2/20 0.31
▸ PRKACB P22694 2/20 0.31
▸ CSNK1A1 P48729 2/20 0.31
▸ CSNK1D P48730 2/20 0.31
▸ CSNK1E P49674 2/20 0.31
▸ CLK1 P49759 2/20 0.31
▸ GSK3B P49841 2/20 0.31
▸ CSNK1G2 P78368 2/20 0.31
▸ CDK5 Q00535 2/20 0.31
▸ CDK5R1 Q15078 2/20 0.31
▸ CCNB3 Q8WWL7 2/20 0.31
▸ CSNK1G1 Q9HCP0 2/20 0.31
▸ PDPK1 O15530 1/20 0.31

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
SCHEMBL27967671 0.83 METAP2 (0.38) GPR84HTR2ATRPM8
SCHEMBL2865051 0.81 AGTR1 (0.38) MAPK1GSK3B
SCHEMBL2863834 0.80 ADORA2A (0.36) GPR84CCNB2CDK1CCNB1PRKACA
SCHEMBL27967771 0.78 GPR84 (0.34) GPR84
SCHEMBL27967877 0.77 MGAM (0.33) GPR84
SCHEMBL2873562 0.76 KDR (0.40) MAPK1CYP1A2
SCHEMBL27814890 0.75 MGAM (0.35) TSHRMAPK1
SCHEMBL31305501 0.73 MGAM (0.39) TSHRMAPK1
SCHEMBL27967904 0.73 PYCR1 (0.31) —
SCHEMBL2863973 0.73 MGAM (0.39) TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102119240-B Surface treating agent for copper or copper alloy and use thereof SHIKOKU CHEM 2014-07-30 — — CN disclosed
CN-102119240-A Surface treating agent for copper or copper alloy and use thereof SHIKOKU CHEM 2011-07-06 — — CN disclosed
Send feedback