SCHEMBL5010573

SCHEMBL5010573

O=C(O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 1.00
MEN1 O00255 2/20 1.00
HPGD P15428 2/20 1.00
ENPP2 Q13822 1/20 0.76
CA1 P00915 2/20 0.69
CA4 P22748 2/20 0.69
CA9 Q16790 2/20 0.69
CA2 P00918 1/20 0.69
CA12 O43570 1/20 0.67
CA7 P43166 1/20 0.67
POLB P06746 2/20 0.65
L3MBTL1 Q9Y468 1/20 0.62
ALDH1A1 P00352 3/20 0.62
HTT P42858 1/20 0.59

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
SCHEMBL20010530 0.94 KMT2A (0.88) KMT2AMEN1HPGDENPP2CA1
SCHEMBL14417945 0.92 KMT2A (0.86) KMT2AMEN1HPGDENPP2CA1
SCHEMBL4239479 0.92 ENPP2 (0.88) KMT2AMEN1HPGDENPP2CA1
SCHEMBL17946434 0.91 KMT2A (0.83) KMT2AMEN1HPGDENPP2CA1
SCHEMBL5010625 0.89 KMT2A (0.80) KMT2AMEN1HPGDENPP2CA1
SCHEMBL31667420 0.88 KMT2A (0.78) KMT2AMEN1HPGDENPP2CA1
SCHEMBL5009943 0.88 HPGD (0.78) KMT2AMEN1HPGDENPP2CA1
SCHEMBL5012350 0.88 HPGD (0.78) KMT2AMEN1HPGDENPP2CA1
SCHEMBL5010921 0.87 HPGD (0.76) KMT2AMEN1HPGDENPP2CA1
SCHEMBL3439592 0.86 ENPP2 (1.00) KMT2AMEN1HPGDENPP2CA1

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 5 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
EP-0173207-B1 POLYAMIDE-IMIDES WITH MODIFIED END GROUPS BAYER AG (DE) 1990-09-19 EP disclosed
US-4829140-A Polyamidimides having modified end groups BAYER AKTIENGESELLSCHAFT (DE) 1989-05-09 US disclosed
EP-0173207-A2 Polyamide-imides with modified end groups BAYER AG (DE) 1986-03-05 EP 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.