SCHEMBL18838506

SCHEMBL18838506

O=C(NC1CC12CCN(CCc1ccccc1)CC2)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 3/20 0.54
▸ KCNH2 Q12809 2/20 0.50
▸ DRD4 P21917 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ SIGMAR1 Q99720 3/20 0.49
▸ OPRM1 P35372 3/20 0.48
▸ OPRD1 P41143 3/20 0.48
▸ OPRK1 P41145 2/20 0.48
▸ HRH3 Q9Y5N1 1/20 0.48
▸ HTR2C P28335 2/20 0.48
▸ HTR2B P41595 2/20 0.48
▸ DRD2 P14416 1/20 0.48
▸ HDAC1 Q13547 2/20 0.46
▸ HDAC4 P56524 1/20 0.46
▸ HSD11B1 P28845 1/20 0.46
▸ NAMPT P43490 1/20 0.46
▸ ADRA1A P35348 1/20 0.46
▸ ADRA1B P35368 1/20 0.46
▸ HDAC8 Q9BY41 1/20 0.46

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
SCHEMBL18838298 0.89 HTR2A (0.56) HTR2AKCNH2DRD4MEN1KMT2A
SCHEMBL18838336 0.89 HTR2A (0.56) HTR2AKCNH2DRD4MEN1KMT2A
SCHEMBL18838295 0.89 HTR2A (0.56) HTR2AKCNH2DRD4MEN1KMT2A
SCHEMBL18838376 0.89 KCNH2 (0.60) HTR2AKCNH2DRD4MEN1KMT2A
SCHEMBL18838471 0.88 KCNH2 (0.56) KCNH2DRD4MEN1KMT2ASIGMAR1
SCHEMBL18860282 0.87 HTR2A (0.54) HTR2AKCNH2DRD4MEN1KMT2A
SCHEMBL18838514 0.87 DRD4 (0.51) HTR2AKCNH2DRD4MEN1KMT2A
SCHEMBL29361618 0.87 DRD4 (0.51) HTR2AKCNH2DRD4MEN1KMT2A
SCHEMBL18838368 0.83 CARM1 (0.46) KCNH2MEN1KMT2AOPRM1ADRA1A
SCHEMBL9566447 0.83 HDAC1 (0.50) KCNH2DRD4MEN1KMT2ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3340988-B1 ION CHANNEL INHIBITORY COMPOUNDS, PHARMACEUTICAL FORMULATIONS AND USES AFASCI INC (US) 2025-04-09 — — EP disclosed
CN-108289886-B Ion channel inhibiting compounds, pharmaceutical formulations and uses 安华赛公司 2022-01-28 — — CN disclosed
US-10562857-B2 Ion channel inhibitory compounds, pharmaceutical formulations, and uses AFASCI, INC. (US) 2020-02-18 — — US disclosed
US-10562857-B2 Ion channel inhibitory compounds, pharmaceutical formulations, and uses AFASCI, INC. (US) 2020-02-18 — — US disclosed
US-20180312471-A1 Ion Channel Inhibitory Compounds, Pharmaceutical Formulations, and Uses AFASCI, INC. (US) 2018-11-01 — — US disclosed
EP-3340988-A1 ION CHANNEL INHIBITORY COMPOUNDS, PHARMACEUTICAL FORMULATIONS AND USES Afasci, Inc. (US) 2018-07-04 — — EP disclosed
WO-2017083867-A1 ION CHANNEL INHIBITORY COMPOUNDS, PHARMACEUTICAL FORMULATIONS AND USES AFASCI, INC. (US) 2017-05-18 — — WO disclosed
WO-2017083867-A1 ION CHANNEL INHIBITORY COMPOUNDS, PHARMACEUTICAL FORMULATIONS AND USES AFASCI, INC. (US) 2017-05-18 — — 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 (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-10562857-B2 Ion channel inhibitory compounds, pharmaceutical formulations, and uses CACNA1I, CACNA1G, CACNA1H HTR2A 354/4885KCNH2 55/4885DRD4 446/4885
US-20180312471-A1 Ion Channel Inhibitory Compounds, Pharmaceutical Formulations, and Uses CACNA1I, CACNA1G, CACNA1H HTR2A 354/4885KCNH2 55/4885DRD4 446/4885

“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.

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