SCHEMBL24722331

SCHEMBL24722331

CCCCCCC(=O)c1cc(OC)c(OC)c(OC)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
ALDH1A1 P00352 2/20 0.55
KDM4E B2RXH2 1/20 0.55
THRA P10827 1/20 0.53
THRB P10828 1/20 0.53
POLB P06746 1/20 0.52
MAPK1 P28482 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
GAA P10253 1/20 0.51
HSD17B3 P37058 5/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
THPO P40225 1/20 0.50
MTOR P42345 1/20 0.50
HTR1A P08908 2/20 0.49
HTR2C P28335 2/20 0.49
HTR2A P28223 1/20 0.49
SLC6A4 P31645 1/20 0.49
HTR7 P34969 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
SCHEMBL7834034 0.98 MEN1 (0.56) MEN1KMT2AALDH1A1KDM4ETHRA
SCHEMBL7835759 0.93 MEN1 (0.58) MEN1KMT2AALDH1A1KDM4ETHRA
SCHEMBL7837299 0.86 ALDH1A1 (0.61) MEN1KMT2AALDH1A1KDM4EMAPK1
SCHEMBL11042463 0.86 MEN1 (0.51) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL5841291 0.85 MEN1 (0.53) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL9828028 0.84 MEN1 (0.62) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL9588048 0.83 THRA (0.66) THRATHRBHSD17B3
SCHEMBL29178467 0.83 THRA (0.49) MEN1KMT2ATHRATHRBHSD17B3
SCHEMBL6628602 0.82 POLB (0.61) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL8507477 0.82 MEN1 (0.53) MEN1KMT2AALDH1A1KDM4EPOLB

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-2022251191-A1 ONE-COMPONENT DELIVERY SYSTEM FOR NUCLEIC ACIDS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2022-12-01 WO disclosed