SCHEMBL5205790

SCHEMBL5205790

COc1cc(-c2ccc(NC(=O)CCN(C)CCC(=O)Nc3ccc(-c4cc(OC)c(SC)c(OC)c4)nc3)cn2)cc(OC)c1SC

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.41
WNT3A P56704 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 3/20 0.39
LMNA P02545 1/20 0.39
CYP3A4 P08684 1/20 0.39
PDE4B Q07343 1/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
HIF1A Q16665 1/20 0.37
MAPK1 P28482 2/20 0.37
TERT O14746 1/20 0.37
NOTUM Q6P988 1/20 0.36

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
SCHEMBL5205885 0.82 HIF1A (0.45) PTPN1WNT3AMEN1KMT2ALMNA
SCHEMBL5208125 0.80 TLR9 (0.34) MEN1KMT2AALDH1A1PDE4BKDM4E
SCHEMBL5208764 0.77 NPC1 (0.54) PTPN1WNT3AMEN1KMT2AALDH1A1
SCHEMBL5210798 0.73 KMT2A (0.35) MEN1KMT2AALDH1A1LMNAPDE4B
SCHEMBL5208405 0.73 SMPD1 (0.33) CYP3A4
SCHEMBL5205794 0.73 KDM1A (0.34) ALDH1A1KDM4E
SCHEMBL5207056 0.72 SMN1; SMN2 (0.50) PTPN1WNT3AMEN1KMT2AMAPT
SCHEMBL5209760 0.71 RAB9A (0.38) PTPN1MEN1KMT2AALDH1A1LMNA
SCHEMBL5204521 0.69 BRD4 (0.40)
SCHEMBL5210723 0.68 KDM1A (0.43) MEN1KMT2AALDH1A1CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1403251-B1 BIS(2-ARYL-5-PYRIDYL) DERIVATIVE KOWA CO (JP) 2007-07-18 EP disclosed
US-6890940-B2 Bis(2-aryl-5-pyridyl) derivatives KOWA CO., LTD. (JP) 2005-05-10 US disclosed
EP-1403251-A1 BIS(2-ARYL-5-PYRIDYL) DERIVATIVE Kowa Co., Ltd. (JP) 2004-03-31 EP disclosed
US-20030022886-A1 Immoglobulin E (IgE) antibody production inhibitor; treating allergic immune diseases such as asthma, dermatitis, inflammatory bowel disease and allergic opthalmopathy KOWA CO., LTD. (JP) 2003-01-30 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-20030022886-A1 Immoglobulin E (IgE) antibody production inhibitor; treating allergic immune diseases such as asthma, dermatitis, inflammatory bowel disease and allergic opthalmopathy IGLV6-57, IL5, IGSF11 PTPN1 580/4885WNT3A 4138/4885MEN1 3218/4885

“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.