SCHEMBL5205394

SCHEMBL5205394

COc1cc(-c2ccc(N3CCN(c4ccc(-c5cc(OC)c(OC)c(OC)c5)nc4)C(CN(C)C)C3)cn2)cc(OC)c1OC

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FYN P06241 1/20 0.38
ACVR1 Q04771 13/20 0.38
TGFBR1 P36897 12/20 0.38
ACVR1B P36896 1/20 0.37
NEK2 P51955 1/20 0.37
GAK O14976 1/20 0.37
KCNH2 Q12809 2/20 0.36
RIPK2 O43353 1/20 0.36
BMPR1A P36894 1/20 0.36
ACVRL1 P37023 1/20 0.36
MAP4K1 Q92918 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
Hydrochloric Acid SCHEMBL5203198 0.99 FYN (0.38) FYNACVR1TGFBR1ACVR1BNEK2
SCHEMBL5209830 0.81 TGFBR1 (0.52) FYNACVR1TGFBR1ACVR1BKCNH2
SCHEMBL5207666 0.78 TGFBR1 (0.49) FYNACVR1TGFBR1ACVR1BKCNH2
SCHEMBL5205444 0.76 TGFBR1 (0.47) FYNACVR1TGFBR1ACVR1BNEK2
SCHEMBL5208695 0.75 ACVR1 (0.53) FYNACVR1TGFBR1ACVR1BKCNH2
Hydrochloric Acid SCHEMBL5210606 0.74 ACVR1 (0.52) FYNACVR1TGFBR1ACVR1BKCNH2
SCHEMBL5203572 0.74 TGFBR1 (0.52) FYNACVR1TGFBR1ACVR1BNEK2
SCHEMBL5208583 0.71 TGFBR1 (0.49) FYNACVR1TGFBR1ACVR1BKCNH2
SCHEMBL5205953 0.69 TGFBR1 (0.48) FYNACVR1TGFBR1ACVR1BNEK2
SCHEMBL5683636 0.66 TGFBR1 (0.55) ACVR1TGFBR1

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 FYN 1448/4885ACVR1 311/4885TGFBR1 237/4885

“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.