SCHEMBL24023977

SCHEMBL24023977

CCc1nccn1CC(C)N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 10/20 0.41
HTR2C P28335 10/20 0.41
HTR2B P41595 5/20 0.41
KCNH2 Q12809 3/20 0.40
TLR8 Q9NR97 2/20 0.40
ALPG P10696 2/20 0.39
PLAA Q9Y263 1/20 0.39
ALPL P05186 1/20 0.38
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA3 P07451 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA13 Q8N1Q1 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 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
SCHEMBL2638232 0.85 KCNH2 (0.42) KCNH2TLR8ALPGPLAAALPL
SCHEMBL8958681 0.81 ALPG (0.42) KCNH2TLR8ALPGPLAAALPL
SCHEMBL23203814 0.81 KCNH2 (0.40) KCNH2TLR8ALPGPLAAALPL
SCHEMBL14478188 0.81 TLR8 (0.50) HTR2AHTR2CHTR2BKCNH2TLR8
SCHEMBL9751289 0.80 TLR8 (0.44) HTR2AHTR2CHTR2BKCNH2TLR8
SCHEMBL19882796 0.77 KMT2A (0.48) HTR2AHTR2CHTR2BCA12CA1
SCHEMBL10852755 0.76 TLR8 (0.42) KCNH2TLR8ALPGPLAAALPL
SCHEMBL18031188 0.76
SCHEMBL13587991 0.76 ALPG (0.45) KCNH2TLR8ALPGPLAAALPL
SCHEMBL464450 0.76

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-20210353610-A1 SMALL MOLECULE MENIN INHIBITORS SERVIER PHARMACEUTICALS LLC 2021-11-18 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-20210353610-A1 SMALL MOLECULE MENIN INHIBITORS MEN1, BRCA1, KRAS HTR2A 951/4885HTR2C 1128/4885HTR2B 404/4885

“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.