SCHEMBL15077290

SCHEMBL15077290

Cc1cc(N)cc(OCCN(C)C)c1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.53
▸ KEAP1 Q14145 1/20 0.46
▸ NFE2L2 Q16236 1/20 0.46
▸ CHRNB2 P17787 2/20 0.44
▸ CHRNA4 P43681 2/20 0.44
▸ HRH3 Q9Y5N1 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ TSHR P16473 1/20 0.43
▸ LTA4H P09960 2/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ NTRK1 P04629 1/20 0.41
▸ ACHE P22303 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40

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
SCHEMBL22831369 0.91 MAPT (0.62) MAPTKEAP1NFE2L2CHRNB2CHRNA4
SCHEMBL3922203 0.89 MAPT (0.60) MAPTKEAP1NFE2L2CHRNB2CHRNA4
SCHEMBL14831492 0.82 MAPT (0.53) MAPTKEAP1NFE2L2CHRNB2CHRNA4
SCHEMBL30935134 0.81 MAPT (0.51) MAPTKEAP1NFE2L2CHRNB2CHRNA4
SCHEMBL30040581 0.81 MAPT (0.51) MAPTKEAP1NFE2L2CHRNB2CHRNA4
SCHEMBL19860565 0.81 MAPT (0.51) MAPTKEAP1NFE2L2CHRNB2CHRNA4
SCHEMBL13095989 0.80 MAPT (0.55) MAPTKEAP1NFE2L2CHRNB2CHRNA4
SCHEMBL22831325 0.79 KCNH2 (0.53) MAPTCHRNB2CHRNA4ALDH1A1MEN1
SCHEMBL24233867 0.79 MAPT (0.79) MAPTKEAP1NFE2L2CHRNB2CHRNA4
SCHEMBL17571472 0.79 MAPT (0.53) MAPTKEAP1NFE2L2CHRNB2CHRNA4

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-20130165440-A1 JAK1 Inhibitors EXELIXIS, INC. (US) 2013-06-27 — — 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-20130165440-A1 JAK1 Inhibitors JAK1, JAK2, JAK3 MAPT 2899/4885KEAP1 1325/4885NFE2L2 1537/4885

“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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