SCHEMBL3247567

SCHEMBL3247567

CCCCc1ccc(Cc2nc(-c3ccccc3)c(C)[nH]2)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.50
PSMB5 P28074 1/20 0.44
GPR84 Q9NQS5 1/20 0.43
HTR1D P28221 1/20 0.40
GCGR P47871 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
BRS3 P32247 1/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PARP1 P09874 1/20 0.39
CDC25B P30305 1/20 0.39
DUSP3 P51452 1/20 0.39
DHODH Q02127 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL3239680 0.96 HSD11B1 (0.49) HSD11B1PSMB5GPR84HTR1DGCGR
SCHEMBL3245335 0.91 HSD11B1 (0.49) HSD11B1GPR84DHODH
SCHEMBL3241546 0.91 HSD11B1 (0.49) HSD11B1GPR84DHODH
SCHEMBL26111911 0.85 GAA (0.50) NPC1TSHRRAB9ASMN1; SMN2GAA
SCHEMBL3241474 0.84 HSD11B1 (0.48) HSD11B1PSMB5GPR84DHODH
SCHEMBL3242206 0.82 GAA (0.42) HSD11B1PSMB5GPR84ADORA3ADORA2A
SCHEMBL2868874 0.81 PRNP (0.49) NPC1RAB9ASMN1; SMN2GAA
SCHEMBL2868334 0.81 MAPK13 (0.44) GCGRNPC1TP53TSHRRAB9A
SCHEMBL3242264 0.81 KCNH2 (0.40) HSD11B1GPR84GCGRNPC1TP53
SCHEMBL3244060 0.80 UCHL3 (0.45) HSD11B1GCGRADORA3ADORA2ATP53

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
CN-102137953-B Surface treating agent for copper or copper alloy and application thereof SHIKOKU CHEM 2014-05-07 CN disclosed
CN-102137953-A Surface treating agent for copper or copper alloy and application thereof SHIKOKU CHEM 2011-07-27 CN disclosed
WO-2010024472-A1 SURFACE TREATING AGENT FOR COPPER OR COPPER ALLOY AND USE THEREOF SHIKOKU CHEMICALS CORPORATION (JP) 2010-03-04 WO disclosed