SCHEMBL16985336

SCHEMBL16985336

Cc1c(N)cnn1C(C)(C)CN1CCOCC1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
CNR2 P34972 3/20 0.34
GAA P10253 2/20 0.33
SMPD3 Q9NY59 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.32
CYP2A13 Q16696 1/20 0.32
LATS1 O95835 1/20 0.32
LATS2 Q9NRM7 1/20 0.32
USP2 O75604 1/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
ALOX15 P16050 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
SIGMAR1 Q99720 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CNR1 P21554 1/20 0.31

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
SCHEMBL16985396 0.85 CYP2A13 (0.36) MAPTCNR2GAASMN1; SMN2LMNA
SCHEMBL16975423 0.78 POLB (0.42) MAPTGAASMN1; SMN2LMNAKDM4E
SCHEMBL15652826 0.74 LMNA (0.34) MAPTCNR2GAASMPD3SMN1; SMN2
SCHEMBL16985426 0.73 MAPT (0.43) MAPTCNR2SMN1; SMN2LMNASIGMAR1
SCHEMBL16975576 0.72 MAP4K4 (0.34) MAPTCNR2GAASMN1; SMN2LATS1
SCHEMBL16985275 0.72 KIT (0.33)
SCHEMBL17076668 0.71 SMN1; SMN2 (0.33) CNR2GAASMN1; SMN2CYP2A13POLB
SCHEMBL16985325 0.71 SMN1; SMN2 (0.35) MAPTCNR2GAASMN1; SMN2CYP2A13
SCHEMBL22876779 0.70
SCHEMBL5020883 0.69 RET (0.31)

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 5 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
EP-3099695-B1 COMPOUNDS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-04-08 EP 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 MAPT 9/4885CNR2 4535/4885GAA 85/4885
US-20170015668-A1 COMPOUNDS LRRK2, PARK7, PINK1 MAPT 6/4885CNR2 4329/4885GAA 32/4885

“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.