Dibenzoylmethane

Dibenzoylmethane

SCHEMBL28456473

CC1=C(C)C(C)C(C)=C1C.O=C(CC(=O)c1ccccc1)c1ccccc1.[Cl-].[Cl-].[Ti+2]

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Dibenzoylmethane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.59
MAPT P10636 5/20 0.59
MEN1 O00255 4/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
HPGD P15428 3/20 0.59
KDM4E B2RXH2 3/20 0.59
TDP1 Q9NUW8 3/20 0.59
CYP3A4 P08684 2/20 0.59
MAPK1 P28482 2/20 0.59
ALOX15 P16050 1/20 0.59
CES1 P23141 1/20 0.59
NPC1 O15118 5/20 0.58
RAB9A P51151 5/20 0.58
ALDH1A1 P00352 4/20 0.53
PLOD2 O00469 2/20 0.53
HIF1A Q16665 2/20 0.53
PLOD3 O60568 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53

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
Dibenzoylmethane SCHEMBL28453613 0.81 HPGD (0.90) KMT2AMAPTMEN1SMN1; SMN2HPGD
Dibenzoylmethane SCHEMBL28899246 0.81 HPGD (0.90) KMT2AMAPTMEN1SMN1; SMN2HPGD
SCHEMBL3208519 0.78 L3MBTL1 (0.46) KMT2AMAPTMEN1SMN1; SMN2HPGD
Dibenzoylmethane SCHEMBL28462129 0.77 KMT2A (0.90) KMT2AMAPTMEN1SMN1; SMN2HPGD
Dibenzoylmethane SCHEMBL28899245 0.77 KMT2A (0.90) KMT2AMAPTMEN1SMN1; SMN2HPGD
Dibenzoylmethane SCHEMBL28459361 0.77 KMT2A (0.90) KMT2AMAPTMEN1SMN1; SMN2HPGD
Dibenzoylmethane SCHEMBL28456807 0.77 KMT2A (0.90) KMT2AMAPTMEN1SMN1; SMN2HPGD
Dibenzoylmethane SCHEMBL21800928 0.77 KMT2A (0.90) KMT2AMAPTMEN1SMN1; SMN2HPGD
Dibenzoylmethane SCHEMBL39582 0.77 MEN1 (1.00) KMT2AMAPTMEN1SMN1; SMN2HPGD
Dibenzoylmethane SCHEMBL1704711 0.77 MEN1 (1.00) KMT2AMAPTMEN1SMN1; SMN2HPGD

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
CN-111499777-A Ultrahigh molecular weight polyethylene catalyst, and preparation method and application thereof 江苏扬农化工集团有限公司 2020-08-07 CN disclosed