SCHEMBL24322900

SCHEMBL24322900

CN(C(=O)[C@@H]1CCCN1)C1CCN(C(=O)Cc2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
KDM4E B2RXH2 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
POLB P06746 2/20 0.47
TACR3 P29371 1/20 0.44
HSD11B1 P28845 1/20 0.44
SCN4A P35499 1/20 0.44
TP53 P04637 1/20 0.43
CCR5 P51681 1/20 0.43
TSHR P16473 1/20 0.43
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC9 Q9UKV0 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
SCHEMBL24322750 0.84 SIGMAR1 (0.56) CCR5KCNH2DRD2HTR2AHTR2C
SCHEMBL24322708 0.82 OPRM1 (0.54) CCR5OPRD1OPRK1KCNH2DRD2
SCHEMBL24322905 0.81 CCR4 (0.54) ALDH1A1KDM4EL3MBTL1CCR5TSHR
SCHEMBL24323862 0.76 HTR6 (0.47) ALDH1A1KDM4ESCN4ATP53
SCHEMBL7123330 0.73 SCN4A (0.50) SCN4A
SCHEMBL3332522 0.73 SCN4A (0.50) ALDH1A1SCN4A
SCHEMBL7122076 0.73 SCN4A (0.50) SCN4A
SCHEMBL7302727 0.73 SCN4A (0.53) L3MBTL1POLBSCN4AHPGDHTR2C
SCHEMBL24322461 0.73 CCR4 (0.55) SCN4ACCR5SIGMAR1
SCHEMBL24322754 0.72 CCR4 (0.51) SCN4ACCR5SIGMAR1

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 ALDH1A1 4556/4885KDM4E 4426/4885L3MBTL1 2569/4885

“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.