SCHEMBL22358307

SCHEMBL22358307

CC(=O)N1CCN(c2nc(-c3ccc4c(C)nn(C)c4c3)no2)CC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.47
LMNA P02545 5/20 0.47
HTT P42858 2/20 0.47
NPC1 O15118 1/20 0.47
TP53 P04637 4/20 0.41
FAAH O00519 1/20 0.41
CREBBP Q92793 2/20 0.41
SCD5 Q86SK9 2/20 0.40
THRB P10828 2/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 1/20 0.39
SMO Q99835 1/20 0.39
BRD4 O60885 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.38

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
SCHEMBL22358167 0.89 MAPT (0.45) MAPTLMNAHTTNPC1TP53
SCHEMBL22357796 0.88 SCD5 (0.45) MAPTLMNAHTTNPC1TP53
SCHEMBL20676409 0.87 MAPT (0.43) MAPTLMNAHTTNPC1SCD5
SCHEMBL30720965 0.87 MAPT (0.49) MAPTLMNAHTTNPC1TP53
SCHEMBL20117016 0.87 MAPT (0.49) MAPTLMNAHTTNPC1TP53
SCHEMBL20116921 0.85 MAPT (0.48) MAPTLMNAHTTNPC1TP53
SCHEMBL22357973 0.85 ALDH1A1 (0.44) MAPTLMNAHTTNPC1FAAH
SCHEMBL26998386 0.85 MAPT (0.41) MAPTLMNAHTTNPC1TP53
SCHEMBL22357800 0.84 GRM5 (0.47) MAPTLMNAHTTKMT2AALDH1A1
SCHEMBL20116299 0.83 KHK (0.45) MAPTLMNAHTTNPC1SCD5

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 2 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-20200262828-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2020-08-20 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 (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 22/4885LMNA 1966/4885HTT 6/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 MAPT 22/4885LMNA 1966/4885HTT 6/4885

“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.