SCHEMBL6842777

SCHEMBL6842777

CC(=O)N1CCC(Oc2ccn3nc(C)c(-c4nc(-c5c(F)cccc5CO)c(-c5nc[nH]n5)s4)c3c2)CC1

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.30
KCNH2 Q12809 1/20 0.30
CHEK2 O96017 1/20 0.30

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
SCHEMBL6845096 0.92 P2RX3 (0.32) IGF1RKCNH2CHEK2
SCHEMBL954510 0.90 IGF1R (0.35) IGF1RKCNH2
SCHEMBL954657 0.86 IKBKB (0.37) IGF1RKCNH2CHEK2
SCHEMBL6842774 0.82 MEN1 (0.31) KCNH2
SCHEMBL6842770 0.82 LMNA (0.35) IGF1RKCNH2
SCHEMBL16937985 0.76 IGF1R (0.34) IGF1RKCNH2
SCHEMBL952263 0.74 KHK (0.36) IGF1RKCNH2
SCHEMBL6845067 0.74 MEN1 (0.32)
SCHEMBL13256713 0.73 MAP4K1 (0.32)
SCHEMBL6845055 0.73 CNR1 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9090601-B2 Thiazole derivatives MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-07-28 US disclosed
US-20110003807-A1 Thiazole derivatives MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-01-06 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-20110003807-A1 Thiazole derivatives MTOR, RICTOR, AKT2 IGF1R 57/4885KCNH2 4419/4885CHEK2 873/4885

“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.