SCHEMBL16985473

SCHEMBL16985473

Cc1c(N)cnn1CC(C)N1CCOCC1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
SMPD3 Q9NY59 1/20 0.33
MCHR1 Q99705 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
KDM1A O60341 1/20 0.31
AAK1 Q2M2I8 1/20 0.31
CREBBP Q92793 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31
MAPT P10636 1/20 0.30
KCNA5 P22460 1/20 0.30
KCNH2 Q12809 1/20 0.30
SYK P43405 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
SCHEMBL16985339 0.79 ALDH1A1 (0.51) LMNAKMT2AMEN1ALDH1A1GAA
SCHEMBL16985426 0.76 MAPT (0.43) LMNAMAPT
SCHEMBL6154539 0.74 HTR2A (0.34)
SCHEMBL16975496 0.72 KMT2A (0.36) LMNAKMT2AMEN1MCHR1ALDH1A1
SCHEMBL16651692 0.72 LMNA (0.37) LMNA
SCHEMBL16651691 0.72 LMNA (0.37) LMNA
SCHEMBL15652826 0.71 LMNA (0.34) LMNAKMT2AMEN1SMPD3ALDH1A1
SCHEMBL22876845 0.70 TSHR (0.34) LMNA
SCHEMBL5020888 0.69 HTR2A (0.35)
SCHEMBL15652391 0.69 HTR2A (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10618901-B2 LRRK2 inhibitors for the treatment of Parkinson's disease GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-04-14 US disclosed
US-20170015668-A1 COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-01-19 US disclosed
US-20170015668-A1 COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-01-19 US disclosed
WO-2015113452-A1 COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2015-08-06 WO 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 (2 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-10618901-B2 LRRK2 inhibitors for the treatment of Parkinson's disease LRRK2, PARK7, PINK1 LMNA 1157/4885KMT2A 2126/4885MEN1 4432/4885
US-20170015668-A1 COMPOUNDS LRRK2, PARK7, PINK1 LMNA 802/4885KMT2A 2719/4885MEN1 4512/4885

“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.