SCHEMBL17066522

SCHEMBL17066522

COc1ccc(NC(=O)C(Sc2cccc[n+]2O)c2ccccc2)cc1Cl

nearest known ligand 0.80

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PCTP Q9UKL6 7/20 0.80
ALDH1A1 P00352 6/20 0.59
LMNA P02545 3/20 0.59
MAPT P10636 2/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
STARD10 Q9Y365 3/20 0.54
STARD7 Q9NQZ5 1/20 0.53
KDM4E B2RXH2 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
PAX8 Q06710 1/20 0.51
POLB P06746 2/20 0.51
TSHR P16473 1/20 0.51
TP53 P04637 1/20 0.48

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
SCHEMBL1235185 0.89 PCTP (1.00) PCTPALDH1A1LMNAMAPTMEN1
SCHEMBL17066524 0.86 PCTP (0.79) PCTPALDH1A1LMNAMAPTMEN1
SCHEMBL17066528 0.82 PCTP (0.78) PCTPALDH1A1LMNAMAPTKMT2A
SCHEMBL17066575 0.82 PCTP (0.77) PCTPALDH1A1LMNAMAPTMEN1
SCHEMBL17066490 0.79 PCTP (0.79) PCTPALDH1A1LMNAMAPTMEN1
SCHEMBL12903628 0.78 PCTP (0.77) PCTPALDH1A1LMNAMAPTMEN1
SCHEMBL17066590 0.75 PCTP (0.79) PCTPALDH1A1LMNAMAPTMEN1
SCHEMBL1235095 0.75 PCTP (1.00) PCTPALDH1A1LMNAMAPTMEN1
SCHEMBL17066525 0.74 PCTP (0.78) PCTPALDH1A1LMNAMAPTMEN1
SCHEMBL12903625 0.73 NPSR1 (0.71) PCTPALDH1A1LMNAMAPTMEN1

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-9556129-B2 Phosphatidylcholine transfer protein inhibitors THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2017-01-31 US disclosed
US-20150336902-A1 Phosphatidylcholine Transfer Protein Inhibitors THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2015-11-26 US disclosed
US-9126938-B2 Phosphatidylcholine transfer protein inhibitors THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2015-09-08 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-20150336902-A1 Phosphatidylcholine Transfer Protein Inhibitors PCTP, LCAT, CETP PCTP 1/4885ALDH1A1 4289/4885LMNA 2945/4885

“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.