SCHEMBL10989184

SCHEMBL10989184

COc1ccc(C(=O)Oc2cccc3cccnc23)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.72
METAP2 P50579 1/20 0.72
METAP1 P53582 1/20 0.72
HDAC6 Q9UBN7 1/20 0.72
ALDH1A1 P00352 8/20 0.63
KDM4E B2RXH2 7/20 0.63
L3MBTL1 Q9Y468 6/20 0.63
NPSR1 Q6W5P4 5/20 0.63
MAPT P10636 4/20 0.63
GAA P10253 1/20 0.63
PRSS1 P07477 1/20 0.62
ACR P10323 1/20 0.62
POLB P06746 1/20 0.58
HTT P42858 3/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C19 P33261 1/20 0.56
USP2 O75604 1/20 0.55
ESR1 P03372 1/20 0.54
ESR2 Q92731 1/20 0.54

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
SCHEMBL11199491 0.85 LMNA (0.78) LMNAMETAP2METAP1HDAC6ALDH1A1
Benzoxiquine SCHEMBL360626 0.84 LMNA (1.00) LMNAMETAP2METAP1HDAC6ALDH1A1
Benzoxiquine SCHEMBL29729484 0.84 LMNA (1.00) LMNAMETAP2METAP1HDAC6ALDH1A1
Benzoxiquine SCHEMBL30599448 0.84 LMNA (1.00) LMNAMETAP2METAP1HDAC6ALDH1A1
SCHEMBL11074045 0.82 LMNA (0.65) LMNAMETAP2METAP1HDAC6ALDH1A1
SCHEMBL28178582 0.81 LMNA (0.72) LMNAMETAP2METAP1HDAC6ALDH1A1
SCHEMBL13674015 0.81 LMNA (0.72) LMNAMETAP2METAP1HDAC6ALDH1A1
SCHEMBL13396893 0.81 LMNA (0.72) LMNAMETAP2METAP1HDAC6ALDH1A1
SCHEMBL13396854 0.81 LMNA (0.67) LMNAMETAP2METAP1HDAC6ALDH1A1
SCHEMBL19084337 0.80 ESR1 (0.62) LMNAALDH1A1L3MBTL1MAPTPRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4530931-A 8-Quinoline carbanilates for the inhibition of lipolysis USV PHARMACEUTICAL CORP. (US) 1985-07-23 US disclosed