SCHEMBL6178729

SCHEMBL6178729

COc1cccc(-c2nc(-c3ccc(C#N)cc3)n(O)c2-c2cccc(C)n2)c1F

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38
MAPK14 Q16539 3/20 0.37
SQOR Q9Y6N5 1/20 0.36
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
MDM2 Q00987 4/20 0.35
FYN P06241 1/20 0.35
DHODH Q02127 1/20 0.35
TGFBR1 P36897 6/20 0.35
TP53 P04637 1/20 0.34

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
SCHEMBL6178736 0.85 TGFBR1 (0.38) MEN1KMT2AATMMDM2TGFBR1
SCHEMBL6183901 0.85 KDM1A (0.40) MEN1KMT2AATM
SCHEMBL6180753 0.78 TGFBR1 (0.40) MEN1KMT2AATMMAPK14TGFBR1
SCHEMBL6183282 0.78 IDO1 (0.45) MAPK14FYNTGFBR1TP53
SCHEMBL6183430 0.73 TGFBR1 (0.41) MEN1KMT2AATMMAPK14TGFBR1
SCHEMBL4075747 0.69 MEN1 (0.46) MEN1KMT2AATMMAPK14SQOR
SCHEMBL6483937 0.69 TGFBR1 (0.40) ATMMAPK14TGFBR1
SCHEMBL6183426 0.67 KMT2A (0.36) MEN1KMT2AATMMAPK14TGFBR1
SCHEMBL3265486 0.67 CCR1 (0.54) TGFBR1
SCHEMBL21083355 0.66 EGLN2 (0.49) TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6906089-B2 Triarylimidazole derivatives as cytokine inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2005-06-14 US disclosed
EP-1268465-B1 TRIARYLIMIDAZOLE DERIVATIVES AS CYTOKINE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2005-06-01 EP disclosed
US-20030149277-A1 Triarylimidazole derivatives as cytokine inhibitors SMITHKLINE BEECHAM CORPORATION 2003-08-07 US disclosed
EP-1268465-A1 TRIARYLIMIDAZOLE DERIVATIVES AS CYTOKINE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-01-02 EP disclosed
WO-2001072737-A1 TRIARYLIMIDAZOLE DERIVATIVES AS CYTOKINE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-10-04 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-20030149277-A1 Triarylimidazole derivatives as cytokine inhibitors IL2, IL2RA, IL6ST MEN1 3492/4885KMT2A 3101/4885ATM 1978/4885

“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.