SCHEMBL24943534

SCHEMBL24943534

CC(C)N1CCC(OCCC(C)N2CCOCC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 16/20 0.44
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SIGMAR1 Q99720 2/20 0.35

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
SCHEMBL13741291 0.80 HRH3 (0.51) HRH3MEN1KMT2A
SCHEMBL20131146 0.79 HRH3 (0.41) HRH3MEN1KMT2ASIGMAR1
SCHEMBL16997002 0.79 HRH3 (0.39) HRH3
SCHEMBL23103224 0.78 SIGMAR1 (0.33) HRH3SIGMAR1
SCHEMBL20795828 0.78 HRH3 (0.35) HRH3KMT2ASIGMAR1
SCHEMBL23114312 0.74 SIGMAR1 (0.33) HRH3SIGMAR1
SCHEMBL12026488 0.73 HRH3 (0.41) HRH3
SCHEMBL22794630 0.72 HRH3 (0.37) HRH3
SCHEMBL29348172 0.72 NPC1 (0.36) HRH3SIGMAR1
SCHEMBL23435356 0.72 HRH3 (0.39) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230013778-A1 SUBSTITUTED TRICYCLIC COMPOUNDS LUPIN LIMITED (IN) 2023-01-19 — — 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-20230013778-A1 SUBSTITUTED TRICYCLIC COMPOUNDS SOS1, RSU1, KSR1 HRH3 2175/4885MEN1 31/4885KMT2A 4241/4885

“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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