SCHEMBL4145558

SCHEMBL4145558

O=C(O)c1ccc2cc3n(c2c1)C(OCc1ccccn1)CNCc1ccccc1-3

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 7/20 0.40
PARP10 Q53GL7 1/20 0.36
AURKB Q96GD4 1/20 0.36
INCENP Q9NQS7 1/20 0.36
SMO Q99835 2/20 0.34
CYP2C9 P11712 1/20 0.34
KCNH2 Q12809 1/20 0.34
NTRK1 P04629 1/20 0.34
NTRK3 Q16288 1/20 0.34
DHODH Q02127 1/20 0.34
RPS6KA2 Q15349 1/20 0.34
SLC6A4 P31645 1/20 0.33
LPL P06858 1/20 0.33
LIPC P11150 1/20 0.33
LIPG Q9Y5X9 1/20 0.33
DRD4 P21917 1/20 0.33
RPS6KA3 P51812 1/20 0.33

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
SCHEMBL4143768 0.91 SYK (0.32) SYKAURKBINCENPRPS6KA2RPS6KA3
SCHEMBL4144600 0.91 RPS6KA2 (0.32) SYKRPS6KA2RPS6KA3
SCHEMBL4139604 0.87 RPS6KA2 (0.34) RPS6KA2RPS6KA3
SCHEMBL4144632 0.85 RPS6KA2 (0.34) RPS6KA2RPS6KA3
SCHEMBL4146049 0.85 TBXAS1 (0.42) RPS6KA2RPS6KA3
SCHEMBL3092098 0.82 SRD5A2 (0.36) RPS6KA2RPS6KA3
SCHEMBL3083812 0.77 RPS6KA2 (0.43) RPS6KA2RPS6KA3
SCHEMBL3081008 0.77 SRD5A2 (0.38) RPS6KA2RPS6KA3
SCHEMBL3079143 0.73 GPR84 (0.42) SYKPARP10SMORPS6KA2RPS6KA3
SCHEMBL4145557 0.71 SYK (0.43) SYKAURKBINCENPRPS6KA2RPS6KA3

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-20090136449-A1 Tetracyclic Indole Derivatives as Antiviral Agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-05-28 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-20090136449-A1 Tetracyclic Indole Derivatives as Antiviral Agents IDO1, IDO2, ZC3HAV1 SYK 4386/4885PARP10 2196/4885AURKB 1350/4885

“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.