SCHEMBL15966565

SCHEMBL15966565

C=C(CCN)c1ccccc1C

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.59
MAOB P27338 1/20 0.59
TAAR1 Q96RJ0 1/20 0.42
ERCC5 P28715 1/20 0.39
FEN1 P39748 1/20 0.39
CHRM1 P11229 1/20 0.38
CTNNB1 P35222 3/20 0.38
WNT3A P56704 3/20 0.38
HPGD P15428 2/20 0.37
MYC P01106 1/20 0.36
TSHR P16473 1/20 0.36
ACHE P22303 1/20 0.36
KMT2A Q03164 1/20 0.36
RECQL P46063 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL7197694 0.83 MAOA (0.55) MAOAMAOBERCC5FEN1CTNNB1
SCHEMBL21930706 0.81 MAOA (0.53) MAOAMAOBERCC5FEN1CTNNB1
SCHEMBL7193411 0.80 MAOA (0.51) MAOAMAOBERCC5FEN1CHRM1
SCHEMBL25137479 0.79 MAOA (0.50) MAOAMAOBERCC5FEN1CTNNB1
SCHEMBL29175153 0.79 MAOA (0.50) MAOAMAOBCHRM1TSHRKMT2A
SCHEMBL9255791 0.78 MAOA (0.58) MAOAMAOBERCC5FEN1CTNNB1
SCHEMBL2313481 0.78 MAOA (0.58) MAOAMAOBERCC5FEN1CTNNB1
SCHEMBL21758653 0.77 MAOA (0.49) MAOAMAOBERCC5FEN1CTNNB1
SCHEMBL29118808 0.77 MAOA (0.49) MAOAMAOBERCC5FEN1CTNNB1
SCHEMBL10899148 0.77 MAOA (0.56) MAOAMAOBERCC5FEN1CTNNB1

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
WO-2023101543-A1 NOVEL PHOSPHOR SYNTHESIZED FROM NATURAL SUBSTANCE AND PREPARATION METHOD THEREFOR 서울대학교 산학협력단 2023-06-08 WO disclosed
EP-2499148-B1 CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS POLYPHOR AG (CH) 2017-01-18 EP disclosed
WO-2014127111-A1 PEPTOIDS THAT BIND SPECIFIC ANTIGENS THE SCRIPPS RESEARCH INSTITUTE (US) 2014-08-21 WO disclosed