SCHEMBL5010936

SCHEMBL5010936

Cc1ccccc1CN1C(=O)c2ccc(C(=O)O)cc2C1=O

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.68
MEN1 O00255 2/20 0.68
HPGD P15428 2/20 0.68
LMNA P02545 1/20 0.63
POLB P06746 2/20 0.61
CACNA1G O43497 4/20 0.60
ENPP2 Q13822 1/20 0.56
ALDH1A1 P00352 1/20 0.54
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA4 P22748 1/20 0.52
CA9 Q16790 1/20 0.52
NPSR1 Q6W5P4 1/20 0.51

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
SCHEMBL12700245 0.86 KMT2A (0.72) KMT2AMEN1HPGDPOLBENPP2
SCHEMBL25705423 0.86 KMT2A (0.59) KMT2AMEN1HPGDLMNAPOLB
SCHEMBL21012277 0.86 CACNA1G (0.60) KMT2AMEN1HPGDLMNACACNA1G
SCHEMBL18132362 0.86 CACNA1G (0.60) KMT2AMEN1HPGDLMNAPOLB
SCHEMBL5010059 0.84 KMT2A (0.68) KMT2AMEN1HPGDPOLBCACNA1G
SCHEMBL5010938 0.84 KMT2A (0.72) KMT2AMEN1HPGDPOLBCACNA1G
SCHEMBL5010540 0.83 KMT2A (0.64) KMT2AMEN1HPGDPOLBENPP2
SCHEMBL18132357 0.82 KMT2A (0.61) KMT2AMEN1HPGDPOLBENPP2
SCHEMBL5010573 0.81 KMT2A (1.00) KMT2AMEN1HPGDPOLBENPP2
SCHEMBL10304923 0.81 PTGS1 (0.65) KMT2AMEN1HPGDLMNAPOLB

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-7319098-B2 1,3-dioxoisoindole derivatives having selective antagonism of T-type calcium channel KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2008-01-15 US disclosed
US-20070259867-A1 1,3-DIOXOISOINDOLE DERIVATIVES HAVING SELECTIVE ANTAGONISM OF T-TYPE CALCIUM CHANNEL KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY 2007-11-08 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-20070259867-A1 1,3-DIOXOISOINDOLE DERIVATIVES HAVING SELECTIVE ANTAGONISM OF T-TYPE CALCIUM CHANNEL CACNA1I, CACNA1G, CACNA1H KMT2A 4804/4885MEN1 959/4885HPGD 1902/4885

“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.