SCHEMBL24183458

SCHEMBL24183458

C[C@@H]1CCCN(C2CCCNCC2)C1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.35
ADRA1A P35348 11/20 0.34
ALDH1A1 P00352 2/20 0.33
L3MBTL3 Q96JM7 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
LMNA P02545 2/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL18427060 1.00 HTR6 (0.35) HTR6ADRA1AALDH1A1L3MBTL3L3MBTL1
Hydrochloric Acid SCHEMBL28842926 0.98 ALDH1A1 (0.35) HTR6ADRA1AALDH1A1L3MBTL3L3MBTL1
SCHEMBL1961905 0.94 ADRA1A (0.36) HTR6ADRA1AALDH1A1L3MBTL3L3MBTL1
SCHEMBL16823762 0.94 ADRA1A (0.36) HTR6ADRA1AALDH1A1L3MBTL3L3MBTL1
Hydrochloric Acid SCHEMBL29877044 0.93 ALDH1A1 (0.38) HTR6ADRA1AALDH1A1L3MBTL3L3MBTL1
Hydrochloric Acid SCHEMBL5912788 0.93 ALDH1A1 (0.38) HTR6ADRA1AALDH1A1L3MBTL3L3MBTL1
Hydrochloric Acid SCHEMBL16827275 0.93 ALDH1A1 (0.38) HTR6ADRA1AALDH1A1L3MBTL3L3MBTL1
SCHEMBL12534 0.86 HTR6 (0.52) HTR6ADRA1AALDH1A1LMNA
SCHEMBL12533 0.86 HTR6 (0.52) HTR6ADRA1AALDH1A1LMNA
SCHEMBL18082909 0.86 HTR6 (0.52) HTR6ADRA1AALDH1A1LMNA

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-20230115270-A1 INHIBITORS OF ADRENORECEPTOR ADRAC2 BAYER AKTIENGESELLSCHAFT (DE) 2023-04-13 US disclosed
WO-2022008426-A1 COMBINATION OF AN ALPHA2-ADRENOCEPTOR SUBTYPE C (ALPHA-2C) ANTAGONIST WITH A TASK1/3 CHANNEL BLOCKER FOR THE TREATMENT OF SLEEP APNEA BAYER AKTIENGESELLSCHAFT (DE) 2022-01-13 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 (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-20230115270-A1 INHIBITORS OF ADRENORECEPTOR ADRAC2 ADRA2C, ADRB2, ADRB3 HTR6 580/4885ADRA1A 17/4885ALDH1A1 2194/4885

“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.