SCHEMBL20116871

SCHEMBL20116871

Cc1noc(N2CCN(c3nc(-c4ccc5cnn(C(C)C)c5c4)no3)CC2)n1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 14/20 0.41
GAA P10253 1/20 0.41
THRB P10828 2/20 0.39
LMNA P02545 5/20 0.39
NPC1 O15118 1/20 0.38
HTT P42858 1/20 0.38
PIK3CD O00329 1/20 0.35
TP53 P04637 4/20 0.35
PTGER3 P43115 1/20 0.33

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
SCHEMBL20117183 0.89 MAPT (0.40) MAPTGAATHRBLMNANPC1
SCHEMBL20117123 0.83 MAPT (0.61) MAPTGAATHRBLMNANPC1
SCHEMBL20116774 0.83 MAPT (0.37) MAPTGAATHRBLMNANPC1
SCHEMBL22358259 0.83 MAPT (0.51) MAPTGAATHRBLMNANPC1
SCHEMBL20117045 0.83 MAPT (0.44) MAPTGAATHRBLMNAPIK3CD
SCHEMBL20116036 0.83 MAPT (0.42) MAPTGAALMNAPIK3CDTP53
SCHEMBL22358261 0.82 HDAC4 (0.43) MAPTTHRBLMNANPC1HTT
SCHEMBL20117145 0.82 MAPT (0.48) MAPTTHRBLMNANPC1HTT
SCHEMBL20116055 0.81 LRRK2 (0.45) MAPTGAATHRBLMNANPC1
SCHEMBL22357990 0.81 MAPT (0.46) MAPTTHRBLMNANPC1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-20200262828-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2020-08-20 US disclosed
WO-2019209948-A9 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-01-02 WO disclosed
WO-2019018795-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2019-01-24 WO disclosed
WO-2018081167-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2018-05-03 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-11873298-B2 Compounds and uses thereof NLN, ACHE, CLN6 MAPT 22/4885GAA 67/4885THRB 4603/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 MAPT 22/4885GAA 67/4885THRB 4603/4885

“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.