SCHEMBL25933566

SCHEMBL25933566

O=P(Oc1ccccc1)(Oc1ccccc1)Oc1ccc(C2(c3ccc(OP(=O)(Oc4ccccc4)Oc4ccccc4)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 2/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
OPRK1 P41145 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
POLB P06746 1/20 0.41
CYP3A4 P08684 1/20 0.40
TSHR P16473 1/20 0.40
SRC P12931 1/20 0.40
GAA P10253 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
ELANE P08246 1/20 0.36
THRB P10828 1/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL25933668 0.90 MEN1 (0.41) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL9160237 0.84 MEN1 (0.46) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL9973246 0.83 SRC (0.53) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL15457022 0.83 PKM (0.46) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL22580553 0.80 MEN1 (0.57) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL13397802 0.78 HTT (0.43) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL10015245 0.78 CYP3A4 (0.61) MEN1KMT2AKDM4ECYP3A4TSHR
SCHEMBL131239 0.78 CYP3A4 (0.61) MEN1KMT2AKDM4ECYP3A4TSHR
SCHEMBL10015247 0.78 CYP3A4 (0.61) MEN1KMT2AKDM4ECYP3A4TSHR
SCHEMBL9185417 0.77 CFTR (0.64) MEN1KMT2ALMNAMAPTSMN1; SMN2

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-20230242830-A1 USE OF OILS COMPRISING NON-NEUROTOXIC ANTI-WEAR ADDITIVES NYCO (FR) 2023-08-03 US disclosed