SCHEMBL13469737

SCHEMBL13469737

CCOCCOc1ccc(C(=O)NC(=S)Nc2ccc(S(=O)(=O)Nc3ccc(OCC)cc3)cc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.69
ALDH1A1 P00352 7/20 0.69
MEN1 O00255 6/20 0.69
NPSR1 Q6W5P4 4/20 0.66
MAPT P10636 3/20 0.66
ALOX12 P18054 3/20 0.66
LMNA P02545 2/20 0.66
POLB P06746 1/20 0.66
GAA P10253 1/20 0.66
HTT P42858 1/20 0.63
GPR55 Q9Y2T6 1/20 0.56
HPGD P15428 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.53
NPC1 O15118 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
SCHEMBL13470033 0.94 ALDH1A1 (0.61) KMT2AALDH1A1MEN1NPSR1MAPT
SCHEMBL17066516 0.94 GPR55 (0.65) KMT2AALDH1A1MEN1NPSR1MAPT
SCHEMBL13469750 0.93 ALDH1A1 (0.70) KMT2AALDH1A1MEN1NPSR1MAPT
SCHEMBL13469775 0.93 ALDH1A1 (0.79) KMT2AALDH1A1MEN1NPSR1MAPT
SCHEMBL13470329 0.92 ALDH1A1 (0.69) KMT2AALDH1A1MEN1NPSR1MAPT
SCHEMBL13453962 0.92 ALDH1A1 (0.72) KMT2AALDH1A1MEN1NPSR1MAPT
SCHEMBL13470012 0.91 ALDH1A1 (0.62) KMT2AALDH1A1MEN1NPSR1MAPT
SCHEMBL13470297 0.91 ALDH1A1 (0.56) KMT2AALDH1A1MEN1NPSR1MAPT
SCHEMBL13454417 0.90 ALDH1A1 (0.69) KMT2AALDH1A1MEN1NPSR1MAPT
SCHEMBL13469741 0.90 ALDH1A1 (0.56) KMT2AALDH1A1MEN1NPSR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9126938-B2 Phosphatidylcholine transfer protein inhibitors THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2015-09-08 US disclosed
US-20120264756-A1 Phosphatidylcholine Transfer Protein Inhibitors THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2012-10-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120264756-A1 Phosphatidylcholine Transfer Protein Inhibitors PCTP, LCAT, CETP KMT2A 1676/4885ALDH1A1 4289/4885MEN1 1940/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.