SCHEMBL4196714

SCHEMBL4196714

CCOC(=O)c1[nH]c2c(c1-c1ccccc1)-c1ccccc1C(=O)C2=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 7/20 0.67
▸ MAPT P10636 6/20 0.67
▸ LMNA P02545 5/20 0.67
▸ XBP1 P17861 2/20 0.67
▸ TDP2 O95551 2/20 0.67
▸ NSD2 O96028 2/20 0.67
▸ PAX8 Q06710 2/20 0.67
▸ NPC1 O15118 2/20 0.67
▸ RAB9A P51151 2/20 0.67
▸ THRB P10828 1/20 0.67
▸ HTT P42858 1/20 0.67
▸ GALK1 P51570 1/20 0.67
▸ BLM P54132 1/20 0.67
▸ ATM Q13315 1/20 0.67
▸ ALDH1A1 P00352 7/20 0.50
▸ HPGD P15428 3/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ MDM2 Q00987 3/20 0.48
▸ PLCG1 P19174 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
SCHEMBL27815872 0.89 ALDH1A1 (0.54) SMN1; SMN2MAPTLMNAXBP1TDP2
SCHEMBL27794679 0.81 MAPT (0.50) SMN1; SMN2MAPTLMNAXBP1TDP2
SCHEMBL27794665 0.79 ALDH1A1 (0.58) SMN1; SMN2MAPTLMNAXBP1TDP2
SCHEMBL27794667 0.78 ALDH1A1 (0.46) SMN1; SMN2MAPTLMNAXBP1TDP2
SCHEMBL28788352 0.76 LMNA (0.55) SMN1; SMN2MAPTLMNAXBP1TDP2
SCHEMBL27794673 0.76 MAPT (0.47) SMN1; SMN2MAPTLMNAXBP1TDP2
SCHEMBL27815864 0.76 AR (0.55) SMN1; SMN2MAPTLMNAXBP1TDP2
SCHEMBL27815840 0.76 ALDH1A1 (0.49) SMN1; SMN2MAPTLMNAXBP1TDP2
SCHEMBL27815846 0.76 MAPT (0.46) SMN1; SMN2MAPTLMNAXBP1TDP2
SCHEMBL27815851 0.75 MAPT (0.61) SMN1; SMN2MAPTLMNAXBP1TDP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090036441-A1 Indole Derivatives With Antitumor Activity CELL THERAPEUTICS EUROPE S.R.L. (IT) 2009-02-05 — — 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-20090036441-A1 Indole Derivatives With Antitumor Activity IDO1, IDO2, INMT SMN1; SMN2 4350/4885MAPT 2732/4885LMNA 2106/4885

“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.

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