SCHEMBL3359655

SCHEMBL3359655

c1ccc(Cc2nc(-c3ccc4ccccc4c3)c[nH]2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
CYP1A1 P04798 1/20 0.44
CYP1B1 Q16678 1/20 0.44
GSK3B P49841 1/20 0.43
CYP1A2 P05177 2/20 0.42
CA12 O43570 1/20 0.42
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
AR P10275 2/20 0.41
NR1H2 P55055 2/20 0.41
NR1H3 Q13133 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL31305486 1.00 CYP11B1 (0.44) CYP11B1CYP11B2CYP1A1CYP1B1GSK3B
SCHEMBL26109800 0.88 NR1H2 (0.45) CYP11B1CYP11B2CYP1A1CYP1B1CYP1A2
SCHEMBL26111615 0.86 ADORA2A (0.45) CYP1A1CYP1B1GSK3BCYP1A2NPC1
SCHEMBL31305554 0.86 GRIN1 (0.40) CYP11B1CYP11B2GSK3BCYP1A2NR1H2
SCHEMBL26108692 0.86 GRIN1 (0.40) CYP11B1CYP11B2GSK3BCYP1A2NR1H2
SCHEMBL3359422 0.85 CYP11B1 (0.40) CYP11B1CYP11B2CYP1A1CYP1B1CYP1A2
SCHEMBL31305471 0.85 CYP11B1 (0.40) CYP11B1CYP11B2CYP1A1CYP1B1CYP1A2
SCHEMBL3856407 0.85 NR1H2 (0.50) GSK3BNPC1RAB9ASMN1; SMN2NR1H2
SCHEMBL31305468 0.83 SMN1; SMN2 (0.41) CYP11B1CYP11B2CYP1A1CYP1B1CYP1A2
SCHEMBL3362112 0.83 ADORA2A (0.42) CYP11B1CYP11B2CYP1A2CTRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4506488-A1 SURFACE TREATMENT AGENT FOR COPPER OR COPPER ALLOY Shikoku Chemicals Corporation (JP) 2025-02-12 EP disclosed
WO-2023190263-A1 SURFACE TREATMENT AGENT FOR COPPER OR COPPER ALLOY 四国化成工業株式会社 2023-10-05 WO disclosed
CN-102131959-B Surface treating agent for copper or copper alloy and application thereof SHIKOKU CHEM 2013-07-17 CN disclosed
CN-102131959-A Surface treating agent for copper or copper alloy and application thereof SHIKOKU CHEM 2011-07-20 CN disclosed
WO-2010024421-A1 SURFACE TREATING AGENT FOR COPPER OR COPPER ALLOY AND USE THEREOF SHIKOKU CHEMICALS CORPORATION (JP) 2010-03-04 WO disclosed