SCHEMBL24323862

SCHEMBL24323862

CN(C(=O)[C@@H]1CCCN1)C1CCN(S(=O)(=O)c2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.47
NPC1 O15118 1/20 0.46
GFER P55789 1/20 0.46
CHRM5 P08912 1/20 0.46
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
SCN4A P35499 1/20 0.44
GAA P10253 2/20 0.44
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
EPHX2 P34913 1/20 0.44
ATM Q13315 1/20 0.43
USP5 P45974 1/20 0.43
TP53 P04637 1/20 0.42

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
SCHEMBL28003015 0.79 KMT2A (0.55) NPC1CHRM5KMT2AMEN1GAA
SCHEMBL24322750 0.78 SIGMAR1 (0.56)
SCHEMBL24322900 0.76 ALDH1A1 (0.50) SCN4AALDH1A1KDM4ETP53
SCHEMBL24322708 0.76 OPRM1 (0.54) KMT2AMEN1
SCHEMBL13194992 0.76 KMT2A (0.56) NPC1CHRM5KMT2AMEN1GAA
SCHEMBL24322905 0.75 CCR4 (0.54) KMT2AMEN1GAAALDH1A1KDM4E
SCHEMBL3332522 0.74 SCN4A (0.50) SCN4AALDH1A1
SCHEMBL7122076 0.74 SCN4A (0.50) SCN4A
SCHEMBL7123330 0.74 SCN4A (0.50) SCN4A
SCHEMBL24322685 0.73 CCR4 (0.53)

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-20220122691-A1 HtrA Inhibitors and CagA Inhibitors and Use Thereof Psomagen Inc. (US) 2022-04-21 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-20220122691-A1 HtrA Inhibitors and CagA Inhibitors and Use Thereof HTRA1, GIPR, HPN HTR6 41/4885NPC1 2900/4885GFER 2940/4885

“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.