SCHEMBL3591016

SCHEMBL3591016

c1cc2c(ccc3cc(-c4ccc(N5CCOCC5)cc4)[nH]c32)cn1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPK10 P53779 1/20 0.50
▸ TBK1 Q9UHD2 8/20 0.43
▸ RPS6KA3 P51812 1/20 0.43
▸ RPS6KA2 Q15349 1/20 0.43
▸ RPS6KA1 Q15418 1/20 0.43
▸ FGFR1 P11362 2/20 0.42
▸ FLT1 P17948 2/20 0.42
▸ ITK Q08881 1/20 0.42
▸ TRPV1 Q8NER1 1/20 0.41
▸ XDH P47989 1/20 0.41
▸ KDR P35968 1/20 0.41
▸ NPY5R Q15761 1/20 0.41
▸ CSF1R P07333 1/20 0.40
▸ IMPDH2 P12268 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
SCHEMBL3599017 0.87 RPS6KA3 (0.44) RPS6KA3RPS6KA2RPS6KA1FGFR1FLT1
SCHEMBL3606588 0.79 CLK1 (0.44) RPS6KA3FGFR1KDRIMPDH2
SCHEMBL3596588 0.78 MAPK10 (0.43) MAPK10RPS6KA3RPS6KA2RPS6KA1FGFR1
SCHEMBL3599649 0.77 CDK1 (0.44) RPS6KA3FGFR1KDRIMPDH2
SCHEMBL3603159 0.76 CDK4 (0.48) NPY5R
SCHEMBL824839 0.74 GSK3B (0.47) MAPK10TBK1FGFR1FLT1ITK
SCHEMBL30824500 0.72 MAPK10 (0.55) MAPK10RPS6KA3RPS6KA2RPS6KA1FGFR1
SCHEMBL13503103 0.69 CCNB2 (0.61) TBK1
SCHEMBL1663706 0.69 XDH (0.48) TBK1ITKXDHCSF1R
SCHEMBL4196958 0.68 MAPK14 (0.62) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2118102-B1 TRICYCLIC INDOLES AND (4,5-DIHYDRO) INDOLES NERVIANO MEDICAL SCIENCES SRL (IT) 2013-06-12 — — EP disclosed
US-8207180-B2 Tricyclic indoles and (4,5-dihydro) indoles NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-06-26 — — US disclosed
US-20100075998-A1 TRICYCLIC INDOLES AND (4,5-DIHYDRO) INDOLES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2010-03-25 — — 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-20100075998-A1 TRICYCLIC INDOLES AND (4,5-DIHYDRO) INDOLES CDC7, CDK7, CDK17 MAPK10 884/4885TBK1 1611/4885RPS6KA3 219/4885

“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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