SCHEMBL19486807

SCHEMBL19486807

CC(C)N1CCN(c2ccc(-c3cc4c(N5CCN(C(=O)C6CC(C#N)C6)CC5)ccnn4c3)cc2)CC1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RET P07949 12/20 0.38
HRH3 Q9Y5N1 2/20 0.36
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPK1 P28482 1/20 0.35
RUVBL1 Q9Y265 1/20 0.35
MMP2 P08253 1/20 0.35
MMP13 P45452 1/20 0.35
MAPT P10636 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
SCHEMBL19481952 1.00 RET (0.38) RETHRH3TSHRSMN1; SMN2MAPK1
SCHEMBL19481975 0.93 RET (0.39) RETHRH3RUVBL1MMP2MMP13
SCHEMBL19486349 0.93 RET (0.39) RETHRH3RUVBL1MMP2MMP13
SCHEMBL19486486 0.91 RET (0.35) RET
SCHEMBL19481968 0.91 RET (0.35) RET
SCHEMBL19490793 0.90 HRH3 (0.38) RETHRH3TSHRSMN1; SMN2MAPK1
SCHEMBL19481946 0.90 RET (0.37) RETHRH3
SCHEMBL19481807 0.89 HRH3 (0.43) HRH3TSHRSMN1; SMN2MAPK1RUVBL1
SCHEMBL25155081 0.89 MC4R (0.39) RET
SCHEMBL19481906 0.89 KMT2A (0.38) RETMAPK1MAPT

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 2428/4885TSHR 1171/4885

“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.