SCHEMBL8076152

SCHEMBL8076152

C=CCc1[c]nccc1Cc1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.33
BCL2L1 Q07817 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
CALM1 P0DP23 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
MMP9 P14780 1/20 0.32
MET P08581 1/20 0.32
HTR2A P28223 1/20 0.32
PAX8 Q06710 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAOB P27338 1/20 0.31
KDM6B O15054 1/20 0.30
ALKBH2 Q6NS38 1/20 0.30
ALKBH3 Q96Q83 1/20 0.30
FTO Q9C0B1 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
SCHEMBL7687255 0.74 HTR2A (0.37) BCL2BCL2L1CALM1HTR2ASMN1; SMN2
SCHEMBL3607193 0.71 ADRA2B (0.34) L3MBTL1METALDH1A1SMN1; SMN2
SCHEMBL9707223 0.70 HTR2A (0.50) BCL2BCL2L1CALM1L3MBTL1HTR2A
SCHEMBL1594956 0.70 TDP1 (0.42) BCL2BCL2L1TAAR1CALM1HTR2A
SCHEMBL2067166 0.69 IMPDH2 (0.36)
SCHEMBL2067217 0.69 XDH (0.37) ALDH1A1
SCHEMBL2329762 0.68 TAAR1 (0.42) TAAR1CALM1L3MBTL1NPC1ALDH1A1
SCHEMBL17968397 0.68 MET (0.43) BCL2BCL2L1TAAR1CALM1MET
SCHEMBL2067168 0.66 IMPDH2 (0.33)
SCHEMBL2067220 0.66 GABRA1 (0.40) L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240102176-A1 ANTICORROSIVE COMPOSITIONS AND METHODS WITH SUPRAMOLECULAR STRUCTURES BPS JUST ENERGY TECHNOLOGY, LLC 2024-03-28 US claimed
WO-2022169765-A1 ANTICORROSIVE COMPOSITIONS AND METHODS WITH SUPRAMOLECULAR STRUCTURES BPS JUST ENERGY TECHNOLOGY, LLC (US) 2022-08-11 WO claimed
US-20240102176-A1 ANTICORROSIVE COMPOSITIONS AND METHODS WITH SUPRAMOLECULAR STRUCTURES BPS JUST ENERGY TECHNOLOGY, LLC 2024-03-28 US disclosed
WO-2022169765-A1 ANTICORROSIVE COMPOSITIONS AND METHODS WITH SUPRAMOLECULAR STRUCTURES BPS JUST ENERGY TECHNOLOGY, LLC (US) 2022-08-11 WO disclosed
EP-1015663-A1 CORROSION INHIBITION THROUGH THE USE OF A QUATERNARY PYRIDINE SALT-HYDROCARBON COMBINATION Stanchem Inc. (CA) 2000-07-05 EP disclosed
WO-1998033953-A1 CORROSION INHIBITION THROUGH THE USE OF A QUATERNARY PYRIDINE SALT-HYDROCARBON COMBINATION STANCHEM INC. (CA) 1998-08-06 WO disclosed