SCHEMBL31717844

SCHEMBL31717844

CC(C)c1ccc(CC(=O)N[C@H]2CN(c3ccc(C#N)nn3)C[C@@H]2O)cc1F

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PANK3 Q9H999 19/20 0.64
RET P07949 1/20 0.40

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
SCHEMBL31717534 1.00 PANK3 (0.64) PANK3RET
SCHEMBL21406136 1.00 PANK3 (0.64) PANK3RET
SCHEMBL19747958 1.00 PANK3 (0.64) PANK3RET
SCHEMBL26502448 0.88 PANK3 (0.49) PANK3RET
SCHEMBL26501577 0.88 PANK3 (0.49) PANK3RET
SCHEMBL21406258 0.86 PANK3 (0.61) PANK3RET
SCHEMBL21406351 0.86 PANK3 (0.61) PANK3RET
SCHEMBL21406452 0.86 PANK3 (0.61) PANK3RET
SCHEMBL21406192 0.86 PANK3 (0.61) PANK3RET
SCHEMBL19748463 0.84 PANK3 (0.67) PANK3

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
WO-2025227071-A1 METHODS AND COMPOSITIONS FOR TREATING HEART FAILURE AND LIVER DISEASE THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2025-10-30 WO claimed
WO-2025227071-A1 METHODS AND COMPOSITIONS FOR TREATING HEART FAILURE AND LIVER DISEASE THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2025-10-30 WO disclosed