SCHEMBL7796046

SCHEMBL7796046

CCCCCc1cc2cc(N)ccc2o1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.47
SRC P12931 1/20 0.46
TLR8 Q9NR97 3/20 0.46
MAPT P10636 1/20 0.46
FLT3 P36888 1/20 0.44
F2 P00734 1/20 0.43
F10 P00742 1/20 0.43
STS P08842 1/20 0.42
CA2 P00918 1/20 0.41
NPC1 O15118 1/20 0.38
DRD2 P14416 1/20 0.37
MAOA P21397 1/20 0.37

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
SCHEMBL284155 0.95 TLR8 (0.50) ALOX15SRCTLR8MAPTFLT3
Hydrochloric Acid SCHEMBL5395881 0.94 TLR8 (0.52) ALOX15SRCTLR8MAPTFLT3
SCHEMBL8179634 0.88 TLR8 (0.47) SRCTLR8FLT3F2F10
SCHEMBL7469284 0.81 ALOX15 (0.47) ALOX15TLR8MAPTF2F10
SCHEMBL12117962 0.80 MAPT (0.46) ALOX15TLR8MAPTF2F10
SCHEMBL2271571 0.79 ALOX15 (0.63) ALOX15MAPTFLT3CA2
SCHEMBL7463986 0.79 MAPT (0.48) ALOX15TLR8MAPTF2F10
SCHEMBL937843 0.79 ALOX15 (0.71) ALOX15SRCMAPTSTSNPC1
SCHEMBL252581 0.78 MAPT (0.60) ALOX15MAPTDRD2MAOA
SCHEMBL28158648 0.78 SRC (0.56) SRCMAPTFLT3CA2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010034445-A1 Vitronectin receptor antagonists SMITHKLINE BEECHAM CORPORATION 2001-10-25 US disclosed
US-6159964-A Vitronectin receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 2000-12-12 US disclosed
EP-0895475-A4 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2000-08-23 EP disclosed
EP-0906103-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-04-07 EP disclosed
EP-0906103-A4 1999-04-07 EP disclosed
EP-0869787-A4 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 1999-03-24 EP disclosed
EP-0895475-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-02-10 EP disclosed
EP-0869787-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1998-10-14 EP disclosed
WO-1997024124-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-07-10 WO disclosed
WO-1997024119-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-07-10 WO disclosed
WO-1997024122-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-07-10 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 (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-20010034445-A1 Vitronectin receptor antagonists ADGRF1, GPR174, CALCRL ALOX15 1812/4885SRC 3786/4885TLR8 2262/4885

“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.