SCHEMBL9951213

SCHEMBL9951213

Nc1ncnc2c1c(-c1cccc(OCC34CCC(CC3)O4)c1)cn2[C@H]1CC[C@H](N2CC[C@@H](F)C2)CC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 16/20 0.71
▸ INSR P06213 5/20 0.70
▸ KCNH2 Q12809 2/20 0.70
▸ PKN1 Q16512 1/20 0.70
▸ LCK P06239 3/20 0.57
▸ KDR P35968 2/20 0.57
▸ ROCK2 O75116 2/20 0.57
▸ LYN P07948 2/20 0.57
▸ AURKA O14965 1/20 0.57
▸ PAK4 O96013 1/20 0.57
▸ CHEK2 O96017 1/20 0.57
▸ CSF1R P07333 1/20 0.57
▸ FGFR1 P11362 1/20 0.57
▸ RPS6KB1 P23443 1/20 0.57
▸ MARK3 P27448 1/20 0.57
▸ FLT4 P35916 1/20 0.57
▸ FLT3 P36888 1/20 0.57
▸ CSNK1D P48730 1/20 0.57
▸ BLK P51451 1/20 0.57
▸ NEK2 P51955 1/20 0.57

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
SCHEMBL1442605 1.00 IGF1R (0.71) IGF1RINSRKCNH2PKN1LCK
SCHEMBL9950271 1.00 IGF1R (0.71) IGF1RINSRKCNH2PKN1LCK
SCHEMBL9951211 1.00 IGF1R (0.71) IGF1RINSRKCNH2PKN1LCK
SCHEMBL1442604 1.00 IGF1R (0.71) IGF1RINSRKCNH2PKN1LCK
SCHEMBL9951186 0.92 IGF1R (0.72) IGF1RINSRKCNH2PKN1LCK
SCHEMBL9949816 0.92 IGF1R (0.72) IGF1RINSRKCNH2PKN1LCK
SCHEMBL9949820 0.92 IGF1R (0.72) IGF1RINSRKCNH2PKN1LCK
SCHEMBL9949824 0.92 IGF1R (0.72) IGF1RINSRKCNH2PKN1LCK
SCHEMBL9951184 0.92 IGF1R (0.72) IGF1RINSRKCNH2PKN1LCK
SCHEMBL9951003 0.90 IGF1R (0.72) IGF1RINSRKCNH2PKN1LCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120165310-A1 ETHER DERIVATIVES OF BICYCLIC HETEROARYLS NOVARTIS AG (CH) 2012-06-28 — — 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-20120165310-A1 ETHER DERIVATIVES OF BICYCLIC HETEROARYLS ETV6, CYP11B2, CYP11B1 IGF1R 2735/4885INSR 695/4885KCNH2 3657/4885

“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.

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