SCHEMBL9101341

SCHEMBL9101341

CC(C)[C@@H](CN1CCCC1)N(C)C(=O)c1ccc(Br)c(F)c1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 1/20 0.38
▸ ADRA2B P18089 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ SIGMAR1 Q99720 1/20 0.38
▸ HRH3 Q9Y5N1 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
SCHEMBL9101350 1.00 CHRM2 (0.38) CHRM2ADRA2BDRD3SIGMAR1HRH3
SCHEMBL9102642 1.00 CHRM2 (0.38) CHRM2ADRA2BDRD3SIGMAR1HRH3
SCHEMBL9105374 0.99 CHRM2 (0.40) CHRM2ADRA2BDRD3SIGMAR1HRH3
SCHEMBL9105364 0.99 CHRM2 (0.40) CHRM2ADRA2BDRD3SIGMAR1HRH3
SCHEMBL9102709 0.85 CHRM2 (0.41) CHRM2ADRA2BDRD3SIGMAR1HRH3
SCHEMBL9102725 0.85 CHRM2 (0.41) CHRM2ADRA2BDRD3SIGMAR1HRH3
SCHEMBL9103849 0.84 — —
SCHEMBL9103842 0.84 — —
SCHEMBL9102588 0.84 SLC6A4 (0.43) —
SCHEMBL31478979 0.84 SLC6A4 (0.43) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025082731-A1 INTRANASAL FORMULATIONS FOR TREATING OBSTRUCTIVE SLEEP APNEA MOSANNA THERAPEUTICS AG (CH) 2025-04-24 — — WO disclosed
US-20130143858-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS ASTRAZENECA AB (SE) 2013-06-06 — — US disclosed
US-8361998-B2 Compounds and their use as IKACh blockers ASTRAZENECA AB 2013-01-29 — — US disclosed
WO-2012074469-A1 NEW IKACH BLOCKERS ASTRAZENECA AB (SE) 2012-06-07 — — WO disclosed
US-20120142659-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS ASTRAZENECA AB (SE) 2012-06-07 — — 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-20130143858-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS KCNH2, KCNJ2, KCNH3 CHRM2 55/4885ADRA2B 165/4885DRD3 1463/4885
US-20120142659-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS KCNH2, KCNJ2, KCNH3 CHRM2 55/4885ADRA2B 165/4885DRD3 1463/4885

“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.

Send feedback