SCHEMBL3356971

SCHEMBL3356971

O=C(O)c1c(OCc2ccccc2)c(=O)ccn1CCOCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.51
HTT P42858 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 1/20 0.51
HPGD P15428 1/20 0.51
NPC1 O15118 2/20 0.47
NPSR1 Q6W5P4 1/20 0.46
GAA P10253 2/20 0.39
POLB P06746 1/20 0.39
LMNA P02545 1/20 0.39
TEAD3 Q99594 1/20 0.39
MAPK14 Q16539 3/20 0.39
NR4A1 P22736 1/20 0.38
NR4A2 P43354 1/20 0.38
NR4A3 Q92570 1/20 0.38
KDM4E B2RXH2 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL2279184 0.93 SMN1; SMN2 (0.49) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL6196944 0.89 HTT (0.48) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL3359987 0.89 HTT (0.53) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL29062608 0.87 HTT (0.53) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL3358329 0.86 HTT (0.55) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL29062592 0.84 HTT (0.67) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL29062597 0.83 HTT (0.58) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL18233756 0.82 HTT (0.53) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL3354717 0.82 HTT (0.71) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL6195834 0.81 HTT (0.47) SMN1; SMN2HTTMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100076199-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED PYRIDONE CARBOXYLIC ACIDS GE HEALTHCARE AS (NO) 2010-03-25 US disclosed
US-20100076199-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED PYRIDONE CARBOXYLIC ACIDS GE HEALTHCARE AS (NO) 2010-03-25 US disclosed
US-20100076199-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED PYRIDONE CARBOXYLIC ACIDS GE HEALTHCARE AS (NO) 2010-03-25 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-20100076199-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED PYRIDONE CARBOXYLIC ACIDS PNPO, PGD, PDXK SMN1; SMN2 2855/4885HTT 4051/4885MEN1 694/4885

“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.