SCHEMBL3095903

SCHEMBL3095903

O=C(O)c1ccc2cc3n(c2c1)CCCOc1ccccc1-3

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RPS6KA2 Q15349 16/20 0.43
RPS6KA3 P51812 10/20 0.43
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL19608988 0.81 EGFR (0.39)
SCHEMBL3574670 0.81 SRD5A2 (0.50) RPS6KA2RPS6KA3
SCHEMBL3688920 0.78 RPS6KA2 (0.40) RPS6KA2RPS6KA3
SCHEMBL4665297 0.78 RPS6KA2 (0.37) RPS6KA2RPS6KA3
SCHEMBL3075059 0.75 TBXA2R (0.36)
SCHEMBL4144644 0.74 RPS6KA2 (0.47) RPS6KA2RPS6KA3
SCHEMBL877519 0.73 PRKCA (0.63) NPC1RAB9A
SCHEMBL3083411 0.73 RPS6KA3 (0.52) RPS6KA2RPS6KA3
SCHEMBL3080179 0.73 RPS6KA2 (0.54) RPS6KA2RPS6KA3
SCHEMBL19609005 0.73 PIK3CA (0.39)

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
US-7795247-B2 Tetracyclic indole derivatives as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2010-09-14 US disclosed
US-20090136449-A1 Tetracyclic Indole Derivatives as Antiviral Agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-05-28 US disclosed
US-20060100262-A1 Tetracyclic indole derivatives as antiviral agents ISTITUTO DI RICHERCHEDI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IRMB) (IT) 2006-05-11 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 (2 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-20060100262-A1 Tetracyclic indole derivatives as antiviral agents IDO1, ZC3HAV1, IDO2 RPS6KA2 2765/4885RPS6KA3 1950/4885NPC1 805/4885
US-20090136449-A1 Tetracyclic Indole Derivatives as Antiviral Agents IDO1, IDO2, ZC3HAV1 RPS6KA2 2578/4885RPS6KA3 1194/4885NPC1 1196/4885

“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.