SCHEMBL9541895

SCHEMBL9541895

O=C(Oc1ccc(-c2ccccc2)cc1)C(Cl)(Cl)Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
LMNA P02545 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ELANE P08246 4/20 0.46
NPC1 O15118 2/20 0.45
FABP7 O15540 1/20 0.45
FABP3 P05413 1/20 0.45
FABP5 Q01469 1/20 0.45
KDM4E B2RXH2 1/20 0.45
RAB9A P51151 1/20 0.45
GAA P10253 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP1A2 P05177 1/20 0.44
PKM P14618 1/20 0.44
CYP2C19 P33261 1/20 0.44
TDP1 Q9NUW8 2/20 0.43
MAPT P10636 2/20 0.43
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL987567 0.88 ELANE (0.47) KMT2AMEN1ELANEKDM4ECYP1A2
SCHEMBL1456652 0.85 ELANE (0.52) KMT2AMEN1LMNASMN1; SMN2ELANE
SCHEMBL11221408 0.85 ELANE (0.55) KMT2AMEN1LMNASMN1; SMN2ELANE
SCHEMBL16005531 0.81 ELANE (0.69) LMNAELANENPC1GAACYP2C9
SCHEMBL9543659 0.81 HDAC1 (0.50) KMT2AMEN1LMNASMN1; SMN2NPSR1
Sulfuric Acid SCHEMBL28167233 0.81 ELANE (0.42) KMT2AMEN1SMN1; SMN2ELANEKDM4E
SCHEMBL6721075 0.79 ELANE (0.53) KMT2AMEN1LMNASMN1; SMN2NPSR1
SCHEMBL14155820 0.78 HSD17B10 (0.52) KMT2AELANEPKMHSD17B10
SCHEMBL12128723 0.78 ELANE (0.51) KMT2AMEN1LMNASMN1; SMN2NPSR1
SCHEMBL1347723 0.78 KMT2A (0.53) KMT2AMEN1LMNASMN1; SMN2NPSR1

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
WO-1993014065-A1 PROCESS FOR PREPARING 1,3,5- TRIS(4'-HYDROXYPHENYL)BENZENE AND ITS DERIVATIVES HOECHST CELANESE CORPORATION (US) 1993-07-22 WO disclosed