SCHEMBL6315440

SCHEMBL6315440

COC(=O)c1ccc(Cl)c2[nH]ccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 8/20 0.61
PIM3 Q86V86 2/20 0.50
PIM1 P11309 1/20 0.50
CHEK1 O14757 1/20 0.42
ABL1 P00519 1/20 0.41
CREBBP Q92793 1/20 0.41
KDM4E B2RXH2 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NUDT1 P36639 1/20 0.38
MAP2K1 Q02750 1/20 0.38
P2RX7 Q99572 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38

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
SCHEMBL16382729 0.87 NR4A2 (0.50) NR4A2PIM3PIM1CHEK1ABL1
SCHEMBL7497434 0.86 PIM3 (0.55) NR4A2PIM3PIM1CHEK1CREBBP
SCHEMBL2589245 0.82 NR4A2 (0.60) NR4A2PIM3PIM1CREBBPKDM4E
SCHEMBL31480354 0.81 PIM3 (0.50) NR4A2PIM3PIM1CHEK1CREBBP
SCHEMBL22587514 0.81 PIM3 (0.50) NR4A2PIM3PIM1CHEK1CREBBP
SCHEMBL14774594 0.81 PIM3 (0.50) NR4A2PIM3PIM1CHEK1ABL1
SCHEMBL2588280 0.81 PIM3 (0.50) NR4A2PIM3PIM1CREBBPKDM4E
SCHEMBL28730919 0.80 NR4A2 (0.50) NR4A2PIM3PIM1CHEK1ABL1
SCHEMBL15797513 0.80 P2RX7 (0.54) NR4A2PIM3PIM1CHEK1ABL1
SCHEMBL27205515 0.80 CSNK2A2 (0.46) NR4A2KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8993523-B2 Dimeric IAP inhibitors NOVARTIS AG (CH) 2015-03-31 US disclosed
US-20130309247-A1 DIMERIC IAP INHIBITORS NOVARTIS AG (CH) 2013-11-21 US disclosed
EP-2651919-A1 DIMERIC IAP INHIBITORS Novartis AG (CH) 2013-10-23 EP disclosed
CN-103347874-A Dimeric iap inhibitors NOVARTIS AG 2013-10-09 CN disclosed
WO-2012080271-A1 DIMERIC IAP INHIBITORS NOVARTIS AG (CH) 2012-06-21 WO disclosed
US-6906096-B2 4,7-Disubstituted indoles and methods of making IRM LLC (BM) 2005-06-14 US disclosed
US-20040110944-A1 4,7-Disubstituted indoles and methods of making IRM LLC (BM) 2004-06-10 US disclosed
WO-2004014294-A2 4,7-DISUBSTITUTED INDOLES AND METHODS OF MAKING IRM LLC (BM) 2004-02-19 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 (2 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-20040110944-A1 4,7-Disubstituted indoles and methods of making IDO1, IDO2, INMT NR4A2 1712/4885PIM3 453/4885PIM1 900/4885
US-20130309247-A1 DIMERIC IAP INHIBITORS XIAP, BIRC5, BIRC2 NR4A2 3995/4885PIM3 863/4885PIM1 420/4885

“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.