SCHEMBL3512052

SCHEMBL3512052

CN1CCC(Nc2ccc(C(=O)Nc3n[nH]c4ccc(Cc5cc(F)cc(F)c5)cc34)cc2)CC1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 16/20 0.75
INSR P06213 15/20 0.75
IGF1R P08069 12/20 0.75
NTRK1 P04629 5/20 0.75
AURKA O14965 3/20 0.75
AURKB Q96GD4 3/20 0.75
FLT3 P36888 3/20 0.64
PLK4 O00444 2/20 0.64
DAPK3 O43293 2/20 0.64
PRKCG P05129 2/20 0.64
ROS1 P08922 2/20 0.64
FER P16591 2/20 0.64
LTK P29376 2/20 0.64
FRK P42685 2/20 0.64
MST1R Q04912 2/20 0.64
PTK2 Q05397 2/20 0.64
TNK2 Q07912 2/20 0.64
NTRK3 Q16288 2/20 0.64
MAP4K5 Q9Y4K4 2/20 0.64
JAK2 O60674 1/20 0.64

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
SCHEMBL1334182 0.88 KIT (0.64) ALKINSRIGF1RNTRK1AURKA
SCHEMBL28917625 0.88 INSR (0.68) ALKINSRIGF1RNTRK1AURKA
SCHEMBL3514038 0.87 ALK (0.79) ALKINSRIGF1RNTRK1AURKA
SCHEMBL3513299 0.86 INSR (0.83) ALKINSRIGF1RNTRK1AURKA
SCHEMBL3511212 0.86 ALK (1.00) ALKINSRIGF1RNTRK1AURKA
SCHEMBL1335086 0.85 NTRK1 (0.74) ALKINSRIGF1RNTRK1AURKA
SCHEMBL29763783 0.84 ALK (0.72) ALKINSRIGF1RNTRK1AURKA
SCHEMBL3510936 0.84 ALK (1.00) ALKINSRIGF1RNTRK1AURKA
SCHEMBL3515047 0.84 ALK (0.72) ALKINSRIGF1RNTRK1AURKA
SCHEMBL3510762 0.84 INSR (0.79) ALKINSRIGF1RNTRK1AURKA

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-20100292207-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2010-11-18 US claimed

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-20100292207-A1 SUBSTITUTED INDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS MAP3K19, MAP3K3, MAP3K5 ALK 401/4885INSR 387/4885IGF1R 188/4885

“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.