SCHEMBL27218012

SCHEMBL27218012

CC(C)N1CC(c2ccc(-c3cc4c(N5CCNCC5)ccnn4c3)cc2)C1I

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.38
KIT P10721 1/20 0.33
BMP4 P12644 1/20 0.33
KHK P50053 3/20 0.32
TLR9 Q9NR96 3/20 0.32
TLR7 Q9NYK1 3/20 0.32
TLR8 Q9NR97 1/20 0.31
MC4R P32245 1/20 0.31
HTR7 P34969 2/20 0.30
HTR1A P08908 1/20 0.30
HTR1D P28221 1/20 0.30
HTR1B P28222 1/20 0.30
HTR2B P41595 1/20 0.30
HTR5A P47898 1/20 0.30
HTR6 P50406 1/20 0.30
ACVR1 Q04771 2/20 0.30
KDR P35968 1/20 0.30
TGFBR1 P36897 1/20 0.30
PRKAB1 Q9Y478 1/20 0.30
BMPR1B O00238 1/20 0.30

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
SCHEMBL27218033 0.83 MC4R (0.38) RETMC4R
SCHEMBL19459081 0.82 RET (0.41) RETKITBMP4KHKTLR9
SCHEMBL27218036 0.82 RET (0.47) RETMC4R
Hydrochloric Acid SCHEMBL27218024 0.82 RET (0.36) RETKITBMP4KHKTLR9
SCHEMBL19458993 0.80 TLR9 (0.40) RETKITTLR9TLR7TLR8
Hydrochloric Acid SCHEMBL19459124 0.79 TLR9 (0.40) RETKITTLR9TLR7TLR8
SCHEMBL19482443 0.76 RET (0.41) RETKITBMP4KHKHTR6
SCHEMBL19459216 0.75 RET (0.39) RETKITBMP4KHKHTR6
SCHEMBL19462890 0.75 RET (0.45) RETKITBMP4KHKHTR7
SCHEMBL25777871 0.75 RET (0.38) RETKITKHKTLR9TLR7

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-12595265-B2 Inhibitors of activin receptor-like kinase BLUEPRINT MEDICINES CORPORATION (US) 2026-04-07 US disclosed
US-20240158398-A1 INHIBITORS OF ACTIVIN RECEPTOR-LIKE KINASE BLUEPRINT MEDICINES CORPORATION 2024-05-16 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 (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-20240158398-A1 INHIBITORS OF ACTIVIN RECEPTOR-LIKE KINASE ACVR1, ACVR2A, ACVRL1 RET 50/4885KIT 189/4885BMP4 21/4885
US-12595265-B2 Inhibitors of activin receptor-like kinase ACVR1, ACVRL1, ACVR2A RET 67/4885KIT 688/4885BMP4 218/4885

“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.