SCHEMBL19486349

SCHEMBL19486349

CC(C)N1CCN(c2ccc(-c3cc4c(N5CCN(C(=O)C6CCC(C#N)CC6)CC5)ccnn4c3)cc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RET P07949 10/20 0.39
HRH3 Q9Y5N1 2/20 0.39
IDH1 O75874 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
RUVBL1 Q9Y265 1/20 0.38
MMP2 P08253 1/20 0.38
MMP13 P45452 1/20 0.38
TBK1 Q9UHD2 1/20 0.36
ALDH1A1 P00352 1/20 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
SCHEMBL19481975 1.00 RET (0.39) RETHRH3IDH1TDP1RUVBL1
SCHEMBL19481807 0.93 HRH3 (0.43) HRH3TDP1RUVBL1MMP2MMP13
SCHEMBL19486807 0.93 RET (0.38) RETHRH3RUVBL1MMP2MMP13
SCHEMBL19481952 0.93 RET (0.38) RETHRH3RUVBL1MMP2MMP13
SCHEMBL19486484 0.92 RET (0.39) RETIDH1RUVBL1TBK1ALDH1A1
SCHEMBL19481991 0.92 RET (0.39) RETIDH1RUVBL1TBK1ALDH1A1
SCHEMBL19486351 0.90 HRH3 (0.41) RETHRH3TDP1RUVBL1MMP2
SCHEMBL19486398 0.89 MC4R (0.39) RETALDH1A1
SCHEMBL19481945 0.89 MC4R (0.39) RETALDH1A1
SCHEMBL19486471 0.89 MAPK8 (0.41) RETIDH1TDP1RUVBL1

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
EP-3442977-B1 INHIBITORS OF ACTIVIN RECEPTOR-LIKE KINASE BLUEPRINT MEDICINES CORP (US) 2023-06-28 EP disclosed
US-20170298069-A1 INHIBITORS OF ACTIVIN RECEPTOR-LIKE KINASE BLUEPRINT MEDICINES CORPORATION 2017-10-19 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-20170298069-A1 INHIBITORS OF ACTIVIN RECEPTOR-LIKE KINASE ACVR1, ACVR2A, ACVRL1 RET 50/4885HRH3 2428/4885IDH1 1074/4885

“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.