SCHEMBL18860274

SCHEMBL18860274

CC(C)(C)NC(=O)CN1CCC2(CCCC2NC(=O)c2ccccc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.43
▸ MEN1 O00255 5/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ LMNA P02545 3/20 0.43
▸ HTT P42858 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ CACNA1I Q9P0X4 2/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ CARM1 Q86X55 1/20 0.40
▸ PRMT6 Q96LA8 1/20 0.40
▸ GAA P10253 1/20 0.39
▸ CACNA1H O95180 3/20 0.39
▸ CACNA1G O43497 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ MCHR1 Q99705 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
SCHEMBL18838350 0.94 KMT2A (0.44) KMT2AMEN1ALDH1A1LMNAHTT
SCHEMBL18838394 0.88 LMNA (0.43) KMT2AMEN1ALDH1A1LMNAHTT
SCHEMBL18860345 0.86 CACNA1I (0.59) CACNA1ICYP2D6CACNA1HCACNA1G
SCHEMBL18860331 0.85 CACNA1I (0.45) KMT2AALDH1A1LMNACACNA1ICACNA1H
SCHEMBL18860279 0.85 CARM1 (0.46) KMT2AMEN1CACNA1ICARM1PRMT6
SCHEMBL18838432 0.81 CYP2D6 (0.43) KMT2AMEN1ALDH1A1CYP2D6CARM1
SCHEMBL18860275 0.80 DRD4 (0.54) KMT2AMEN1LMNASMN1; SMN2CYP2D6
SCHEMBL18860180 0.79 CACNA1I (0.61) CACNA1ICYP2D6CACNA1HCACNA1G
SCHEMBL18838359 0.79 CACNA1I (0.61) CACNA1ICYP2D6CACNA1HCACNA1G
SCHEMBL18860178 0.79 CACNA1I (0.61) CACNA1ICYP2D6CACNA1HCACNA1G

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-10562857-B2 Ion channel inhibitory compounds, pharmaceutical formulations, and uses AFASCI, INC. (US) 2020-02-18 — — US 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 (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-10562857-B2 Ion channel inhibitory compounds, pharmaceutical formulations, and uses CACNA1I, CACNA1G, CACNA1H KMT2A 2232/4885MEN1 2540/4885ALDH1A1 2756/4885

“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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