SCHEMBL10154468

SCHEMBL10154468

O=CC1CC1c1n[nH]c2ncccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.38
▸ AURKA O14965 1/20 0.33
▸ PARP1 P09874 1/20 0.33
▸ SLC6A4 P31645 1/20 0.33
▸ PDK2 Q15119 1/20 0.32
▸ LRRK2 Q5S007 1/20 0.32
▸ CNR2 P34972 1/20 0.32
▸ ERN1 O75460 1/20 0.31
▸ AXL P30530 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ FEN1 P39748 1/20 0.31
▸ GPR84 Q9NQS5 1/20 0.30
▸ HTR2A P28223 1/20 0.30
▸ HTR2C P28335 1/20 0.30
▸ HTR2B P41595 1/20 0.30
▸ APP P05067 1/20 0.30
▸ GRM4 Q14833 1/20 0.30
▸ EGFR P00533 1/20 0.30
▸ ERBB2 P04626 1/20 0.30

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
SCHEMBL10154478 0.79 SLC6A4 (0.38) KMT2AAURKAPARP1SLC6A4PDK2
SCHEMBL10154677 0.78 KDM4E (0.41) LRRK2CNR2KDM4EHTR2AHTR2C
SCHEMBL10126647 0.76 MAPK1 (0.36) CNR2APP
SCHEMBL3832735 0.74 PDK2 (0.39) KMT2AAURKAPARP1PDK2LRRK2
SCHEMBL21733021 0.73 PDK2 (0.47) AURKAPARP1PDK2AXLGPR84
SCHEMBL10126746 0.70 MAPT (0.39) KMT2AKDM4EMAPT
SCHEMBL17857651 0.69 HTR1A (0.40) SLC6A4PDK2HTR2C
SCHEMBL25858591 0.69 CRBN (0.57) —
SCHEMBL29935587 0.68 KMT2A (0.50) KMT2AAURKAPARP1LRRK2ERN1
SCHEMBL1639313 0.68 KMT2A (0.50) KMT2AAURKAPARP1LRRK2ERN1

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-20120016117-A1 INDAZOLEPROPIONIC ACID AMIDE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-01-19 — — 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-20120016117-A1 INDAZOLEPROPIONIC ACID AMIDE COMPOUND SCN9A, SCN1A, SCN1B KMT2A 3609/4885AURKA 937/4885PARP1 3546/4885

“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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