SCHEMBL437784

SCHEMBL437784

O=C1CC(=O)N(c2ccccc2)C(=O)N1c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.59
GAA P10253 2/20 0.55
PKM P14618 1/20 0.55
TLR9 Q9NR96 1/20 0.55
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
ALDH1A1 P00352 3/20 0.54
MAPT P10636 1/20 0.53
MGLL Q99685 1/20 0.50
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
OPRK1 P41145 1/20 0.47
PDE4D Q08499 1/20 0.47
ENPP2 Q13822 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL12081988 0.90 MEN1 (0.64) HPGDGAAPKMTLR9MEN1
SCHEMBL22580612 0.90 MEN1 (0.64) HPGDGAAPKMTLR9MEN1
SCHEMBL17358738 0.88 CTSG (0.61) HPGDGAAPKMTLR9MEN1
SCHEMBL17717939 0.87 ENPP2 (0.49) HPGDGAAPKMTLR9MEN1
SCHEMBL5437358 0.86 OPRK1 (0.56) HPGDGAAPKMTLR9MEN1
SCHEMBL17717923 0.84 MEN1 (0.56) HPGDGAAPKMTLR9MEN1
SCHEMBL4422153 0.84 HPGD (0.74) HPGDGAAPKMTLR9MEN1
SCHEMBL11595767 0.82 TSHR (0.47) HPGDGAAPKMTLR9MEN1
SCHEMBL1165628 0.82 HPGD (0.55) HPGDGAAPKMTLR9MEN1
SCHEMBL11182628 0.82 MGLL (0.62) HPGDGAAMEN1KMT2AALDH1A1

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 657 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110028456-B Barbituric acid derivative and preparation method and application thereof 齐鲁工业大学 2021-02-23 CN claimed
CN-110028456-A A kind of barbituric acid derivatives and preparation method and application 齐鲁工业大学 2019-07-19 CN claimed
CN-105310888-B Dental regulation composition 株式会社松风 2019-05-21 CN claimed
US-20170348303-A1 PHARMACEUTICAL COMPOSITIONS CHARLESTON LABORATORIES, INC. 2017-12-07 US claimed
US-9668943-B2 Dental conditioning composition KABUSHIKI KAISHA SHOFU (JP) 2017-06-06 US claimed
US-8158639-B2 Non-sedating barbiturate compounds as neuroprotective agents TARO PHARMACEUTICAL INDUSTRIES LTD. (IL) 2012-04-17 US claimed
US-20100197709-A1 NON-SEDATING BARBITURATE COMPOUNDS AS NEUROPROTECTIVE AGENTS TARO PHARMACEUTICAL INDUSTRIES LTD. (IL) 2010-08-05 US claimed
US-7723346-B2 Non-sedating barbiturate compounds as neuroprotective agents TARO PHARMACEUTICAL INDUSTRIES LTD. (IL) 2010-05-25 US claimed
US-7488762-B2 Two paste-type glass ionomer cement KABUSHIKI KAISHA SHOFU (JP) 2009-02-10 US claimed
EP-1311270-B1 NON-SEDATING BARBITURATE COMPOUNDS AS NEUROPROTECTIVE AGENTS TARO PHARMA IND (IL) 2008-01-09 EP claimed
US-20060205747-A1 Non-sedating barbiturate compounds as neuroprotective agents TARO PHARMACEUTICAL INDUSTRIES LTD. (IL) 2006-09-14 US claimed
EP-1311270-A4 NON-SEDATING BARBITURATE COMPOUNDS AS NEUROPROTECTIVE AGENTS TARO PHARMA IND (IL) 2006-04-12 EP claimed
US-20040224947-A1 Non-sedating barbiturate compounds as neuroprotective agents TARO PHARMACEUTICAL INDUSTRIES LTD (IL) 2004-11-11 US claimed
US-6756379-B2 USING SUCH AS 1,3-DIMETHOXYMETHYL-5,5-DIPHENYL-BARBITURIC ACID TARO PHARMACEUTICAL INDUSTRIES LTD. (IL) 2004-06-29 US claimed
US-20030153589-A1 Non-sedating barbiturate compounds as neuroprotective agents TARO PHARMACEUTICAL INDUSTRIES LTD. (IL) 2003-08-14 US claimed
EP-1311270-A1 NON-SEDATING BARBITURATE COMPOUNDS AS NEUROPROTECTIVE AGENTS TARO PHARMACEUTICAL INDUSTRIES LIMITED (IL) 2003-05-21 EP claimed
WO-2002007729-A9 NON-SEDATING BARBITURATE COMPOUNDS AS NEUROPROTECTIVE AGENTS TARO PHARMA IND (IL) 2002-08-08 WO claimed
WO-2002007729-A1 NON-SEDATING BARBITURATE COMPOUNDS AS NEUROPROTECTIVE AGENTS TARO PHARMACEUTICAL INDUSTRIES LTD. (IL) 2002-01-31 WO claimed
US-RE31986-E Manufacture of organic pigments BASF AKTIENGESELLSCHAFT (DE) 1985-09-17 US claimed
US-4166179-A MANUFACTURE OF ORGANIC PIGMENTS BASF AKTIENGESELLSCHAFT (DE) 1979-08-28 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-20100197709-A1 NON-SEDATING BARBITURATE COMPOUNDS AS NEUROPROTECTIVE AGENTS GABRB1, GABRB2, GABRB3 HPGD 318/4885GAA 3085/4885PKM 2230/4885
US-20060205747-A1 Non-sedating barbiturate compounds as neuroprotective agents GABRB1, GABRB2, GABRB3 HPGD 318/4885GAA 3085/4885PKM 2230/4885
US-20030153589-A1 Non-sedating barbiturate compounds as neuroprotective agents GABRB1, GABRB3, GABRB2 HPGD 325/4885GAA 2899/4885PKM 2201/4885
US-20040224947-A1 Non-sedating barbiturate compounds as neuroprotective agents GABRB1, GABRB2, GABRB3 HPGD 318/4885GAA 3085/4885PKM 2230/4885

“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.