SCHEMBL6000133

SCHEMBL6000133

CC(=O)Oc1ccc2oc(=O)sc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.67
KMT2A Q03164 4/20 0.67
POLB P06746 2/20 0.67
TDP1 Q9NUW8 5/20 0.60
MAPT P10636 5/20 0.60
ALOX12 P18054 4/20 0.60
KDM4E B2RXH2 4/20 0.60
HSD17B10 Q99714 4/20 0.60
ALOX15 P16050 3/20 0.60
CA12 O43570 2/20 0.54
CA9 Q16790 2/20 0.54
GLA P06280 3/20 0.51
GAA P10253 3/20 0.51
LMNA P02545 3/20 0.51
PKM P14618 3/20 0.51
HTT P42858 2/20 0.51
HPGD P15428 2/20 0.51
FLT3 P36888 1/20 0.50
MEN1 O00255 2/20 0.48
GAPDH P04406 2/20 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
SCHEMBL9610688 0.88 KDM4E (0.55) ALDH1A1KMT2APOLBTDP1MAPT
SCHEMBL2191311 0.85 ALDH1A1 (0.61) ALDH1A1KMT2APOLBTDP1MAPT
SCHEMBL11210057 0.84 ALDH1A1 (0.62) ALDH1A1KMT2APOLBTDP1MAPT
SCHEMBL11214982 0.84 ALDH1A1 (0.62) ALDH1A1KMT2APOLBTDP1MAPT
SCHEMBL10104746 0.83 ALDH1A1 (0.60) ALDH1A1KMT2APOLBTDP1MAPT
SCHEMBL11206183 0.81 ALDH1A1 (0.60) ALDH1A1KMT2APOLBTDP1MAPT
SCHEMBL2102718 0.80 ALDH1A1 (0.69) ALDH1A1KMT2APOLBTDP1MAPT
SCHEMBL11213958 0.78 KMT2A (0.56) ALDH1A1KMT2APOLBTDP1MAPT
SCHEMBL11216635 0.77 KMT2A (0.55) ALDH1A1KMT2APOLBTDP1MAPT
SCHEMBL11215076 0.77 KMT2A (0.55) ALDH1A1KMT2APOLBTDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4397942-A LATENT IMAGE STABILIZERS AGFA-GEVAERT AKTIENGESELLSCHAFT (DE) 1983-08-09 US claimed
US-20060234987-A1 Neuroprotective benzo 1 3 oxathiol 2 ones JAQUITH JAMES B 2006-10-19 US disclosed
WO-2005012281-A1 NEUROPROTECTIVE BENZO[1,3]OXATHOL-2-ONES AEGERA THERAPEUTICS INC. (CA) 2005-02-10 WO disclosed
US-4397942-A LATENT IMAGE STABILIZERS AGFA-GEVAERT AKTIENGESELLSCHAFT (DE) 1983-08-09 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-20060234987-A1 Neuroprotective benzo 1 3 oxathiol 2 ones NLN, SMN1; SMN2, TXN2 ALDH1A1 568/4885KMT2A 4306/4885POLB 3034/4885

“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.