SCHEMBL5509146

SCHEMBL5509146

COc1ccc(Oc2ccc(C=C3SC(=O)NC3=O)cc2)cc1

nearest known ligand 0.91

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 7/20 0.91
PIM2 Q9P1W9 7/20 0.91
AKR1B1 P15121 4/20 0.91
NPC1 O15118 1/20 0.91
RAB9A P51151 1/20 0.91
HPGD P15428 3/20 0.75
CSNK2A2 P19784 2/20 0.71
CLK1 P49759 2/20 0.71
CSNK2B P67870 2/20 0.71
CSNK2A1 P68400 2/20 0.71
DYRK1A Q13627 2/20 0.71
DYRK1B Q9Y463 2/20 0.71
POLB P06746 1/20 0.71
DYRK2 Q92630 1/20 0.63
PDE4B Q07343 1/20 0.62
PIM3 Q86V86 1/20 0.62
ADAMTS5 Q9UNA0 2/20 0.61
GSK3B P49841 1/20 0.60
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60

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
SCHEMBL8272567 1.00 PIM1 (0.91) PIM1PIM2AKR1B1NPC1RAB9A
SCHEMBL5509142 1.00 PIM1 (0.91) PIM1PIM2AKR1B1NPC1RAB9A
SCHEMBL2546911 0.95 PIM1 (1.00) PIM1PIM2AKR1B1NPC1RAB9A
SCHEMBL1247708 0.95 PIM1 (1.00) PIM1PIM2AKR1B1NPC1RAB9A
SCHEMBL1247705 0.95 PIM1 (1.00) PIM1PIM2AKR1B1NPC1RAB9A
SCHEMBL3796470 0.86 AKR1B1 (0.67) PIM1PIM2AKR1B1NPC1RAB9A
SCHEMBL3796472 0.86 AKR1B1 (0.67) PIM1PIM2AKR1B1NPC1RAB9A
SCHEMBL1249023 0.86 HPGD (1.00) PIM1PIM2AKR1B1NPC1RAB9A
SCHEMBL1249025 0.86 HPGD (1.00) PIM1PIM2AKR1B1NPC1RAB9A
SCHEMBL1300557 0.86 HPGD (1.00) PIM1PIM2AKR1B1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1781271-A1 ARYLIDENES FOR THE TREATMENT OF ESTROGEN RELATED RECEPTOR-ALPHA MEDIATED DISEASES JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-09 EP claimed
WO-2006019741-A1 ARYLIDENES FOR THE TREATMENT OF ESTROGEN RELATED RECEPTOR-ALPHA MEDIATED DISEASES JANSSEN PHARMACEUTICA N.V. (BE) 2006-02-23 WO claimed
US-20060014812-A1 Use of estrogen related receptor-modulating aryl ethers JANSSEN PHARMACEUTICA N.V. (BE) 2006-01-19 US claimed
EP-1781271-A1 ARYLIDENES FOR THE TREATMENT OF ESTROGEN RELATED RECEPTOR-ALPHA MEDIATED DISEASES JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-09 EP disclosed
WO-2006019741-A1 ARYLIDENES FOR THE TREATMENT OF ESTROGEN RELATED RECEPTOR-ALPHA MEDIATED DISEASES JANSSEN PHARMACEUTICA N.V. (BE) 2006-02-23 WO disclosed
US-20060014812-A1 Use of estrogen related receptor-modulating aryl ethers JANSSEN PHARMACEUTICA N.V. (BE) 2006-01-19 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-20060014812-A1 Use of estrogen related receptor-modulating aryl ethers ESR2, ESRRG, GPER1 PIM1 4500/4885PIM2 4143/4885AKR1B1 332/4885

“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.