SCHEMBL20116249

SCHEMBL20116249

CC(C)n1ncc2ccc(-c3noc(N4CCC(O)(CCCl)CC4)n3)cc21

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.36
GAA P10253 1/20 0.36
LMNA P02545 3/20 0.36
ALOX5AP P20292 2/20 0.35
THRB P10828 1/20 0.35
NPC1 O15118 1/20 0.33
HTT P42858 1/20 0.33
PTGER3 P43115 1/20 0.33
FASN P49327 1/20 0.33
S1PR1 P21453 1/20 0.32
PIK3CD O00329 1/20 0.32

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
SCHEMBL20116774 0.82 MAPT (0.37) MAPTGAALMNAALOX5APTHRB
SCHEMBL20116871 0.80 MAPT (0.41) MAPTGAALMNATHRBNPC1
SCHEMBL20116036 0.79 MAPT (0.42) MAPTGAALMNAALOX5APPTGER3
SCHEMBL20116250 0.79 MAPT (0.39) MAPTGAALMNATHRBNPC1
SCHEMBL20117111 0.79 MAPT (0.35) MAPTGAALMNAALOX5APTHRB
SCHEMBL20116712 0.78 MAPT (0.41) MAPTGAALMNATHRBNPC1
SCHEMBL22358259 0.78 MAPT (0.51) MAPTGAALMNATHRBNPC1
SCHEMBL20117045 0.77 MAPT (0.44) MAPTGAALMNATHRBPTGER3
SCHEMBL20117183 0.77 MAPT (0.40) MAPTGAALMNATHRBNPC1
SCHEMBL20116472 0.76 CYP2C9 (0.42) MAPTGAALMNANPC1HTT

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 67/4885LMNA 1966/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 MAPT 22/4885GAA 67/4885LMNA 1966/4885

“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.