SCHEMBL20100968

SCHEMBL20100968

COC1=C(C2=C(O)C(=O)c3ccccc3C2=O)C(=O)c2ccccc2C1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.62
ALDH1A1 P00352 8/20 0.62
MITF O75030 3/20 0.62
HTT P42858 3/20 0.62
NPSR1 Q6W5P4 1/20 0.62
SMN1; SMN2 Q16637 6/20 0.61
RAB9A P51151 6/20 0.61
KDM4E B2RXH2 5/20 0.61
LMNA P02545 5/20 0.61
POLB P06746 5/20 0.61
HPGD P15428 5/20 0.61
TDP1 Q9NUW8 4/20 0.61
TP53 P04637 3/20 0.61
CDC25A P30304 2/20 0.61
CDC25B P30305 2/20 0.61
MAP2K7 O14733 1/20 0.61
GMNN O75496 1/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2D6 P10635 1/20 0.61

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
SCHEMBL1436501 0.84 MAPT (0.71) MAPTALDH1A1MITFHTTNPSR1
Bilawsone SCHEMBL3768549 0.84 APAF1 (0.75) MAPTALDH1A1HTTNPSR1SMN1; SMN2
Bilawsone SCHEMBL30884954 0.84 APAF1 (0.75) MAPTALDH1A1HTTNPSR1SMN1; SMN2
SCHEMBL14773924 0.77 ME2 (0.74) MAPTALDH1A1MITFHTTNPSR1
SCHEMBL571557 0.77 MAPT (1.00) MAPTALDH1A1MITFHTTNPSR1
SCHEMBL29545010 0.77 MAPT (1.00) MAPTALDH1A1MITFHTTNPSR1
SCHEMBL9628178 0.77 MAPT (1.00) MAPTALDH1A1MITFHTTNPSR1
SCHEMBL26655868 0.75 APAF1 (0.67) MAPTALDH1A1HTTNPSR1SMN1; SMN2
SCHEMBL5191181 0.74 ALDH1A1 (0.62) MAPTALDH1A1MITFHTTNPSR1
SCHEMBL16745426 0.73 APAF1 (0.58) MAPTALDH1A1MITFHTTNPSR1

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-20180116977-A1 NOVEL TREATMENT OF PROSTATE CARCINOMA PELLFICURE PHARMACEUTICALS, INC. 2018-05-03 US disclosed
US-20180116977-A1 NOVEL TREATMENT OF PROSTATE CARCINOMA PELLFICURE PHARMACEUTICALS, INC. 2018-05-03 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-20180116977-A1 NOVEL TREATMENT OF PROSTATE CARCINOMA KLK3, AR, PLK1 MAPT 1003/4885ALDH1A1 347/4885MITF 3325/4885

“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.