SCHEMBL5205885

SCHEMBL5205885

COc1cc(-c2ccc(NC(=O)CCN(C)CCC(=O)Nc3ccc(-c4cc(OC)c(OCC(F)(F)F)c(OC)c4)nc3)cn2)cc(OC)c1OCC(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.45
PSEN1 P49768 1/20 0.41
PSEN2 P49810 1/20 0.41
APH1B Q8WW43 1/20 0.41
NCSTN Q92542 1/20 0.41
APH1A Q96BI3 1/20 0.41
PSENEN Q9NZ42 1/20 0.41
CYP1A2 P05177 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
LMNA P02545 3/20 0.40
MAPT P10636 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
S1PR1 P21453 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
PTPN1 P18031 1/20 0.39
TP53 P04637 2/20 0.39
HTT P42858 1/20 0.38
ENPP1 P22413 1/20 0.38
MEN1 O00255 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
SCHEMBL5205790 0.82 PTPN1 (0.41) HIF1ALMNAMAPTPTPN1MEN1
SCHEMBL5207778 0.82 CYP17A1 (0.36) HIF1ACYP1A2HTR2CHTR2BS1PR1
SCHEMBL5208076 0.81 EGFR (0.45) HIF1ASMN1; SMN2S1PR1
SCHEMBL5208764 0.78 NPC1 (0.54) MAPTSMN1; SMN2PTPN1HTTMEN1
SCHEMBL5207081 0.75 CYP17A1 (0.39) CYP1A2LMNASMN1; SMN2TP53HTT
SCHEMBL5203600 0.75 SCN9A (0.36) SMN1; SMN2PDE4B
SCHEMBL5203313 0.75 SCN9A (0.33) PDE4B
Hydrochloric Acid SCHEMBL5204974 0.74 SCN9A (0.33) PDE4B
SCHEMBL5207056 0.74 SMN1; SMN2 (0.50) MAPTSMN1; SMN2RXFP1PTPN1MEN1
SCHEMBL5207785 0.73 KDM1A (0.33) PDE4B

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 HIF1A 3685/4885PSEN1 183/4885PSEN2 371/4885

“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.