SCHEMBL5447271

SCHEMBL5447271

Cc1c(-c2ccc(N)cc2)c(N2CCCC2N(C)C)n2nc(C(C)(C)C)nc2c1C#N

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 14/20 0.34
KDM4E B2RXH2 4/20 0.32
NPSR1 Q6W5P4 4/20 0.32
HPGD P15428 3/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 3/20 0.31
ALDH1A1 P00352 2/20 0.31
RXFP1 Q9HBX9 2/20 0.31
GRIA2 P42262 1/20 0.31
GRIA4 P48058 1/20 0.31
HTT P42858 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
SCHEMBL5459933 0.91 HPGD (0.35) LRRK2KDM4ENPSR1HPGDLMNA
SCHEMBL5439991 0.91 USP30 (0.34) LRRK2KDM4ENPSR1HPGDLMNA
SCHEMBL5450209 0.90 MAT2A (0.33) LRRK2
SCHEMBL5451079 0.88 MAPT (0.32) KDM4ENPSR1HPGDLMNAPOLB
SCHEMBL5450154 0.84 USP30 (0.34) KDM4ENPSR1HPGDLMNAPOLB
SCHEMBL5444668 0.83 LMNA (0.33) LRRK2KDM4EHPGDLMNAMAPT
SCHEMBL5447275 0.83 EGLN2 (0.36) KDM4ENPSR1HPGDLMNAPOLB
SCHEMBL5447457 0.82 USP30 (0.36) KDM4EHPGDLMNAMAPTALDH1A1
SCHEMBL5458301 0.80 GRM5 (0.36) KDM4ENPSR1HPGDLMNAPOLB
SCHEMBL5442795 0.79 GRM5 (0.35) KDM4ENPSR1HPGDLMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070191395-A1 Heterocyclic compounds having antifungal activity DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-08-16 US disclosed
EP-1717238-A1 FUNGICIDAL HETEROCYCLIC COMPOUNDS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-11-02 EP 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-20070191395-A1 Heterocyclic compounds having antifungal activity ERG28, MANBA, MAN2B1 LRRK2 2012/4885KDM4E 3019/4885NPSR1 3826/4885

“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.