SCHEMBL2997273

SCHEMBL2997273

COc1ccc2c(c1)-c1ccccc1C(=O)C2=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.54
PTPRC P08575 3/20 0.54
MAPT P10636 5/20 0.54
ALDH1A1 P00352 3/20 0.54
HPGD P15428 3/20 0.54
KDM4E B2RXH2 3/20 0.54
RAB9A P51151 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
TDP1 Q9NUW8 3/20 0.54
TP53 P04637 2/20 0.54
LMNA P02545 2/20 0.54
POLB P06746 2/20 0.54
BLM P54132 2/20 0.54
MAP2K7 O14733 1/20 0.54
GMNN O75496 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
ALOX15 P16050 1/20 0.54

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
SCHEMBL23111380 0.96 PTPRC (0.59) PTPN1PTPRCMAPTALDH1A1HPGD
SCHEMBL17439396 0.96 MAPT (0.55) PTPN1MAPTALDH1A1HPGDKDM4E
SCHEMBL4645032 0.92 PTPN1 (0.58) PTPN1PTPRCMAPTALDH1A1HPGD
SCHEMBL2993382 0.92 CA1 (0.53) PTPN1PTPRCMAPTALDH1A1HPGD
SCHEMBL28155812 0.92 CA1 (0.57) PTPN1MAPTALDH1A1HPGDRAB9A
2-Methoxyanthraquinone SCHEMBL222927 0.90 PTPN1 (0.60) PTPN1PTPRCMAPTALDH1A1HPGD
SCHEMBL31669020 0.89 GPR3 (0.59) PTPN1MAPTALDH1A1HPGDKDM4E
SCHEMBL25693544 0.89 GPR3 (0.59) PTPN1MAPTALDH1A1HPGDKDM4E
SCHEMBL10885799 0.88 CA1 (0.53) PTPN1MAPTALDH1A1HPGDRAB9A
SCHEMBL7786812 0.87 CA1 (0.57) PTPN1MAPTALDH1A1HPGDRAB9A

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-20200155609-A1 COMPOSITIONS AND METHODS OF MAKING EXPANDED HEMATOPOIETIC STEM CELLS USING PTEN INHIBITORS TRANSFUSION HEALTH LLC 2020-05-21 US disclosed
US-20100180937-A1 HOLOGRAPHIC ENERGY-COLLECTING MEDIUM AND ASSOCIATED DEVICE GENERAL ELECTRIC COMPANY (US) 2010-07-22 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-20200155609-A1 COMPOSITIONS AND METHODS OF MAKING EXPANDED HEMATOPOIETIC STEM CELLS USING PTEN INHIBITORS PTEN, MCL1, PIK3CA PTPN1 31/4885PTPRC 20/4885MAPT 4692/4885

“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.