SCHEMBL17273526

SCHEMBL17273526

CC(C)(C)OC(=O)N1CCC(c2ccc(-c3cnc4[nH]cc(-c5cnn(CCc6ccccc6)c5)c4c3)cc2F)CC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 14/20 0.48
▸ MAPK1 P28482 1/20 0.42
▸ AXL P30530 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ SGK1 O00141 1/20 0.40
▸ AURKA O14965 1/20 0.40
▸ CAMKK1 Q8N5S9 1/20 0.40
▸ SGK3 Q96BR1 1/20 0.40
▸ CAMKK2 Q96RR4 1/20 0.40
▸ SGK2 Q9HBY8 1/20 0.40

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
SCHEMBL17273261 0.90 ALK (0.59) ALKMAPK1TP53
SCHEMBL17273308 0.90 ALK (0.51) ALKMAPK1SGK1CAMKK2
SCHEMBL17273494 0.89 MAPK1 (0.41) MAPK1AXLLMNATP53SGK1
SCHEMBL17273504 0.88 ALK (0.56) ALKMAPK1
SCHEMBL17273343 0.87 ALK (0.49) ALKMAPK1AXLLMNATP53
SCHEMBL17273331 0.86 ALK (0.48) ALKMAPK1SGK1
SCHEMBL17273395 0.86 ALK (0.48) ALKMAPK1SGK1
SCHEMBL15562854 0.86 ALK (0.53) ALK
SCHEMBL17273498 0.84 ALK (0.52) ALKMAPK1SGK1
SCHEMBL15557710 0.84 ALK (0.54) ALKMAPK1

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-9353107-B2 3-(pyrazolyl)-1H-pyrrolo[2,3-b]pyridine derivatives as kinase inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2016-05-31 — — US disclosed
US-20150336949-A1 3-(Pyrazolyl)-1H-Pyrrolo[2,3-b]Pyridine Derivatives as Kinase Inhibitors Um Pharmauji Sdn. Bhd. (MY) 2015-11-26 — — 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-20150336949-A1 3-(Pyrazolyl)-1H-Pyrrolo[2,3-b]Pyridine Derivatives as Kinase Inhibitors MAP3K3, MAP3K1, MAP3K6 ALK 408/4885MAPK1 97/4885AXL 854/4885

“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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