SCHEMBL11248747

SCHEMBL11248747

CCOC(=O)c1cnc2cccc(C)n2c1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.60
GAA P10253 6/20 0.57
GLA P06280 4/20 0.57
HPGD P15428 5/20 0.56
ALDH1A1 P00352 4/20 0.56
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
POLB P06746 2/20 0.55
HSD17B10 Q99714 4/20 0.49
LMNA P02545 2/20 0.49
MAPK1 P28482 2/20 0.49
MAPT P10636 2/20 0.49
HTT P42858 1/20 0.49
NPC1 O15118 1/20 0.49
TP53 P04637 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49
RAB9A P51151 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
RECQL P46063 1/20 0.49

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
SCHEMBL29531563 0.86 KDM4E (0.43) KDM4EGAAGLAHPGDALDH1A1
SCHEMBL7875409 0.82 GAA (0.51) KDM4EGAAGLAHPGDALDH1A1
SCHEMBL9128607 0.81 KDM4E (0.51) KDM4EGAAHPGDALDH1A1POLB
SCHEMBL11630656 0.80 KMT2A (0.60) KDM4EGAAGLAHPGDALDH1A1
SCHEMBL9130811 0.79 KDM4E (0.42) KDM4EGAAGLAHPGDALDH1A1
SCHEMBL23725461 0.79 KDM4E (0.54) KDM4EGAAGLAHPGDALDH1A1
SCHEMBL11643359 0.78 KDM4E (0.70) KDM4EGAAGLAHPGDALDH1A1
SCHEMBL9126917 0.78 HPGD (0.49) KDM4EGAAGLAHPGDALDH1A1
SCHEMBL9128642 0.78 HPGD (0.44) KDM4EGAAGLAHPGDALDH1A1
SCHEMBL9126550 0.77 HPGD (0.49) KDM4EGAAGLAHPGDALDH1A1

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-116903782-B Polyacrylate fluorescent probe based on benzothiadiazole, synthesis method and application thereof in monitoring lipid droplets 齐鲁工业大学(山东省科学院) 2024-06-11 CN disclosed
CN-114281687-A Method and system for automatically generating unit test input data and test cases 凌云光技术股份有限公司 2022-04-05 CN disclosed
US-4321377-A ANALGESICS, TRANQULIZERS, ANTIARTHERISOSCLEROTIC AGENTS CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1982-03-23 US disclosed