SCHEMBL2448968

SCHEMBL2448968

COCC1=C(c2ncc3ccccn23)C(c2ccc(Cl)c(Cl)c2)n2nccc2N1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 7/20 0.43
ABCC8 Q09428 7/20 0.43
KCNJ11 Q14654 7/20 0.43
KCNJ8 Q15842 7/20 0.43
KMT2A Q03164 5/20 0.36
MEN1 O00255 4/20 0.36
ALDH1A1 P00352 8/20 0.35
KDM4E B2RXH2 7/20 0.35
HPGD P15428 5/20 0.35
MAPT P10636 5/20 0.35
RAB9A P51151 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPK1 P28482 1/20 0.34
NPC1 O15118 1/20 0.32
CHEK1 O14757 1/20 0.32
LIMK1 P53667 1/20 0.32
MAPK14 Q16539 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL2448974 0.86 ABCC9 (0.48) ABCC9ABCC8KCNJ11KCNJ8KMT2A
SCHEMBL2451623 0.84 ALDH1A1 (0.35) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL2448167 0.76 ABCC9 (0.41) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL2446613 0.74 ABCC9 (0.41) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL12332316 0.74 ABCC9 (0.48) ABCC9ABCC8KCNJ11KCNJ8KMT2A
SCHEMBL2452937 0.71 ABCC9 (0.47) ABCC9ABCC8KCNJ11KCNJ8KMT2A
SCHEMBL2449004 0.71 GLA (0.43) ABCC9ABCC8KCNJ11KCNJ8KMT2A
SCHEMBL12332318 0.70 ABCC9 (0.44) ABCC9ABCC8KCNJ11KCNJ8MAPT
SCHEMBL2448648 0.70 ABCC9 (0.43) ABCC9ABCC8KCNJ11KCNJ8KMT2A
SCHEMBL2446037 0.68 LIPG (0.44) ABCC9ABCC8KCNJ11KCNJ8KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1237891-B1 HETEROCYCLIC DIHYDROPYRIMIDINES AS POTASSIUM CHANNEL INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2011-09-28 EP claimed
US-7541362-B2 Heterocyclic dihydropyrimidine compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2009-06-02 US claimed
US-20040063687-A1 Heterocyclic dihydropyrimidine compounds ATWAL KARNAIL S (US) 2004-04-01 US claimed
US-20030022890-A1 Heterocyclic dihydropyrimidine compounds PEDESTRIAN CONCEPTS LLC 2003-01-30 US claimed
EP-1237891-A1 HETEROCYCLIC DIHYDROPYRIMIDINES AS POTASSIUM CHANNEL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-09-11 EP claimed
WO-2001040231-A1 HETEROCYCLIC DIHYDROPYRIMIDINES AS POTASSIUM CHANNEL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2001-06-07 WO claimed
EP-1237891-B1 HETEROCYCLIC DIHYDROPYRIMIDINES AS POTASSIUM CHANNEL INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2011-09-28 EP disclosed
EP-1237891-B1 HETEROCYCLIC DIHYDROPYRIMIDINES AS POTASSIUM CHANNEL INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2011-09-28 EP disclosed
US-7541362-B2 Heterocyclic dihydropyrimidine compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2009-06-02 US disclosed
US-7541362-B2 Heterocyclic dihydropyrimidine compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2009-06-02 US disclosed
US-7541362-B2 Heterocyclic dihydropyrimidine compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2009-06-02 US disclosed
US-20070099899-A1 Heterocyclic dihydropyrimidine compounds ATWAL KARNAIL S 2007-05-03 US disclosed
US-20070099899-A1 Heterocyclic dihydropyrimidine compounds ATWAL KARNAIL S 2007-05-03 US disclosed
US-7157451-B2 Heterocyclic dihydropyrimidine compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-02 US disclosed
US-7157451-B2 Heterocyclic dihydropyrimidine compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-02 US disclosed
US-20040063687-A1 Heterocyclic dihydropyrimidine compounds ATWAL KARNAIL S (US) 2004-04-01 US disclosed
US-6706720-B2 TREATMENT OF ARRHYTHMIA; INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2004-03-16 US disclosed
US-20030022890-A1 Heterocyclic dihydropyrimidine compounds PEDESTRIAN CONCEPTS LLC 2003-01-30 US disclosed
EP-1237891-A1 HETEROCYCLIC DIHYDROPYRIMIDINES AS POTASSIUM CHANNEL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-09-11 EP disclosed
WO-2001040231-A1 HETEROCYCLIC DIHYDROPYRIMIDINES AS POTASSIUM CHANNEL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2001-06-07 WO 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 (3 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-20040063687-A1 Heterocyclic dihydropyrimidine compounds KCNJ2, KCNH2, KCNH1 ABCC9 297/4885ABCC8 292/4885KCNJ11 21/4885
US-20030022890-A1 Heterocyclic dihydropyrimidine compounds KCNJ2, KCNH2, KCNH1 ABCC9 297/4885ABCC8 292/4885KCNJ11 21/4885
US-20070099899-A1 Heterocyclic dihydropyrimidine compounds KCNJ2, KCNQ5, KCNQ2 ABCC9 246/4885ABCC8 268/4885KCNJ11 33/4885

“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.