SCHEMBL24938345

SCHEMBL24938345

Cc1nnnn1C1CCCCCC(N)CCC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.45
ALDH1A1 P00352 5/20 0.43
MAPT P10636 3/20 0.43
TP53 P04637 1/20 0.43
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
HTT P42858 2/20 0.41
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL22096535 1.00 TSHR (0.45) TSHRALDH1A1MAPTTP53MEN1
SCHEMBL16426472 0.89 TSHR (0.53) TSHRALDH1A1MAPTTP53MEN1
SCHEMBL22113418 0.88 TSHR (0.50) TSHRALDH1A1MAPTTP53MEN1
SCHEMBL22096534 0.72 TSHR (0.41) TSHRALDH1A1MAPTTP53MEN1
SCHEMBL9965906 0.72 ALDH1A1 (0.40) TSHRALDH1A1MAPTTP53MEN1
SCHEMBL17001650 0.72 ALOX15 (0.45) TSHRALDH1A1MAPTTP53MEN1
SCHEMBL20816366 0.71 TSHR (0.53) TSHRALDH1A1MAPTTP53MEN1
Hydrochloric Acid SCHEMBL22528409 0.70 ALDH1A1 (0.39) TSHRALDH1A1MAPTMEN1KMT2A
SCHEMBL26685246 0.69 ALDH1A1 (0.37) TSHRALDH1A1MAPTTP53MEN1
SCHEMBL1013139 0.67 TSHR (0.53) TSHRALDH1A1MAPTTP53MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11560368-B2 Apoptosis signal-regulating kinase 1 inhibitors and methods of use thereof ENANTA PHARMACEUTICALS, INC. (US) 2023-01-24 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 (1 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-11560368-B2 Apoptosis signal-regulating kinase 1 inhibitors and methods of use thereof BAD, CASP1, BAX TSHR 2909/4885ALDH1A1 1882/4885MAPT 130/4885

“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.