SCHEMBL28632241

SCHEMBL28632241

CCCCCCOc1ccc(C(=O)CC(=O)c2ccc(Cl)cc2OC)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRA P10827 3/20 0.55
THRB P10828 3/20 0.55
MEN1 O00255 1/20 0.53
GAA P10253 1/20 0.53
KMT2A Q03164 1/20 0.53
PLA2G4B P0C869 2/20 0.50
TP53 P04637 1/20 0.49
TSHR P16473 1/20 0.49
KDM4E B2RXH2 1/20 0.47
SMPD1 P17405 3/20 0.46
RARB P10826 3/20 0.46
PTGES O14684 1/20 0.46

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
SCHEMBL28636758 0.84 MAPT (0.56) MEN1KMT2ATP53KDM4E
SCHEMBL2866720 0.80 TP53 (0.73) THRATHRBGAAPLA2G4BTP53
SCHEMBL9799476 0.80 KMT2A (0.55) THRATHRBMEN1GAAKMT2A
SCHEMBL7913066 0.79 TP53 (0.70) THRATHRBPLA2G4BTP53TSHR
SCHEMBL28632245 0.79 DPP4 (0.52) MEN1GAAKMT2APLA2G4BSMPD1
SCHEMBL28632244 0.78 NPC1 (0.68) MEN1GAAKMT2ATP53TSHR
SCHEMBL2355796 0.77 MAPT (0.66) THRATHRBPLA2G4BTP53TSHR
SCHEMBL2356406 0.77 MAPT (0.66) THRATHRBPLA2G4BTP53TSHR
SCHEMBL16203310 0.76 MAPT (0.68) THRATHRBKMT2APLA2G4BTP53
SCHEMBL10599913 0.76 PLA2G4B (0.51) THRATHRBMEN1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113387790-B Preparation method of chloroalkoxy-1, 3-diphenyl-beta-diketone 佛山华铕光电材料股份有限公司 2022-08-05 CN claimed
CN-113387790-A Preparation method of chloroalkoxy-1, 3-diphenyl-beta-diketone 佛山华铕光电材料股份有限公司 2021-09-14 CN claimed
CN-113387790-B Preparation method of chloroalkoxy-1, 3-diphenyl-beta-diketone 佛山华铕光电材料股份有限公司 2022-08-05 CN disclosed
CN-113387790-A Preparation method of chloroalkoxy-1, 3-diphenyl-beta-diketone 佛山华铕光电材料股份有限公司 2021-09-14 CN disclosed