SCHEMBL22166117

SCHEMBL22166117

CCCCCCc1ccc(C#N)c(OC)n1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.47
ALDH1A1 P00352 3/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
KDM4E B2RXH2 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.42
MAPT P10636 2/20 0.39
THRB P10828 1/20 0.39
AR P10275 2/20 0.39
TSHR P16473 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CYP19A1 P11511 6/20 0.38
HPGD P15428 1/20 0.37
GAA P10253 2/20 0.37
HTT P42858 1/20 0.35

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
SCHEMBL19303144 0.94 ALDH1A1 (0.47) KCNH2ALDH1A1MEN1KMT2AKDM4E
SCHEMBL16224793 0.82 KDM4E (0.53) ALDH1A1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL3971206 0.80 KDM4E (0.50) ALDH1A1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL9338962 0.74 PDE4A (0.46) ALDH1A1KDM4EL3MBTL1HPGDGAA
SCHEMBL19772111 0.74 KDM4E (0.48) ALDH1A1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL7219744 0.73 KCNH2 (0.42) KCNH2ALDH1A1MEN1KMT2AKDM4E
SCHEMBL23462738 0.72 ALDH1A1 (0.48) ALDH1A1KDM4EL3MBTL1MAPTTHRB
SCHEMBL3967032 0.71 KDM4E (0.54) ALDH1A1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL18176098 0.70 KCNH2 (0.42) KCNH2L3MBTL1
SCHEMBL20289391 0.70 AR (0.54) ALDH1A1KDM4EARTSHRHSD17B10

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-10695337-B2 Piperidin-4-yl azetidine derivatives as JAK1 inhibitors INCYTE HOLDINGS CORPORATION (US) 2020-06-30 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-10695337-B2 Piperidin-4-yl azetidine derivatives as JAK1 inhibitors JAK1, JAK2, JAK3 KCNH2 2308/4885ALDH1A1 1457/4885MEN1 2382/4885

“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.