SCHEMBL9908275

SCHEMBL9908275

CCc1ccc(CN(CC)CC)nc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.46
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
KDM4E B2RXH2 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
KMT2A Q03164 4/20 0.43
MAPT P10636 2/20 0.43
MEN1 O00255 3/20 0.40
LMNA P02545 2/20 0.40
ALDH1A1 P00352 2/20 0.38
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL5024697 0.91 HRH3 (0.43) HRH3CYP1A2CYP2D6KDM4EL3MBTL1
SCHEMBL11955565 0.82 HRH3 (0.47) HRH3CYP1A2CYP2D6KDM4EL3MBTL1
SCHEMBL5025697 0.81 KMT2A (0.47) HRH3CYP1A2CYP2D6KDM4EL3MBTL1
SCHEMBL5023073 0.80 KMT2A (0.49) HRH3CYP1A2CYP2D6KDM4EKMT2A
SCHEMBL6865800 0.80 KDM4E (0.41) HRH3CYP1A2CYP2D6KDM4EL3MBTL1
SCHEMBL487617 0.79 HRH3 (0.55) HRH3CYP1A2CYP2D6KDM4EL3MBTL1
SCHEMBL30398570 0.79 HRH3 (0.55) HRH3CYP1A2CYP2D6KDM4EL3MBTL1
SCHEMBL5024694 0.79 KDM4E (0.42) HRH3CYP1A2CYP2D6KDM4EL3MBTL1
SCHEMBL5024698 0.79 KDM4E (0.42) HRH3CYP1A2CYP2D6KDM4EL3MBTL1
SCHEMBL15483889 0.79 HRH3 (0.39) HRH3CYP1A2CYP2D6KDM4EL3MBTL1

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-3619196-B1 2-{[2-(PHENYLOXYMETHYL)PYRIDIN-5-YL]OXY}-ETHANAMIN-DERIVATIVES AND RELATED COMPOUNDS AS PESTICIDES E.G. FOR CROP PROTECTION BAYER CROPSCIENCE AG (DE) 2022-03-30 EP disclosed
US-8198273-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2012-06-12 US disclosed
US-20100286142-A1 Compounds and Methods for Kinase Modulation, and Indications Therefor PLEXXIKON, INC. 2010-11-11 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 (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-20100286142-A1 Compounds and Methods for Kinase Modulation, and Indications Therefor BRAF, ARAF, RAF1 HRH3 3203/4885CYP1A2 3391/4885CYP2D6 2083/4885

“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.