SCHEMBL29303928

SCHEMBL29303928

CN(C)C1CCCN(c2ccc(C(C)(C)C)cc2)C1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FPR1 P21462 1/20 0.48
▸ FPR2 P25090 1/20 0.48
▸ MCHR1 Q99705 7/20 0.42
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ RAB9A P51151 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ HTR2C P28335 1/20 0.39
▸ PIM1 P11309 1/20 0.39
▸ HRH3 Q9Y5N1 2/20 0.38
▸ NOTUM Q6P988 1/20 0.38
▸ HSD11B1 P28845 2/20 0.37
▸ ROCK2 O75116 1/20 0.37
▸ ROCK1 Q13464 1/20 0.37
▸ CDC42BPA Q5VT25 1/20 0.37
▸ CDC42BPB Q9Y5S2 1/20 0.37
▸ SOS1 Q07889 1/20 0.37
▸ HRH4 Q9H3N8 1/20 0.36

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
SCHEMBL12744589 0.91 MCHR1 (0.49) MCHR1HTR2AHTR2CHRH3NOTUM
SCHEMBL12744587 0.91 MCHR1 (0.49) MCHR1HTR2AHTR2CHRH3NOTUM
SCHEMBL25675637 0.84 ACACB (0.39) MCHR1RAB9AHTR2AHTR2CHRH3
SCHEMBL30434185 0.83 PIM1 (0.47) FPR1FPR2MCHR1KMT2APIM1
SCHEMBL25681031 0.83 PIM1 (0.47) FPR1FPR2MCHR1KMT2APIM1
SCHEMBL3440096 0.81 MAPT (0.49) FPR1FPR2MCHR1MEN1KMT2A
SCHEMBL16001187 0.81 HRH3 (0.47) MCHR1HTR2AHTR2CHRH3NOTUM
SCHEMBL31058047 0.81 MCHR1 (0.48) FPR1FPR2MCHR1PIM1NOTUM
SCHEMBL27613690 0.81 MCHR1 (0.48) FPR1FPR2MCHR1PIM1NOTUM
SCHEMBL19012564 0.80 HRH3 (0.43) MEN1KMT2AHRH3HSD11B1

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-20240228463-A1 SODIUM CHANNEL INHIBITORS AND METHODS OF DESIGNING SAME GENENTECH, INC. (US) 2024-07-11 — — US disclosed
US-20240228463-A1 SODIUM CHANNEL INHIBITORS AND METHODS OF DESIGNING SAME GENENTECH, INC. (US) 2024-07-11 — — 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-20240228463-A1 SODIUM CHANNEL INHIBITORS AND METHODS OF DESIGNING SAME CACNA1I, CACNA1B, CACNA1C FPR1 3857/4885FPR2 3068/4885MCHR1 4065/4885

“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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