SCHEMBL19083690

SCHEMBL19083690

CC(=O)N1CCC(C)(C)[C@H]1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.36
POLB P06746 1/20 0.35
VHL P40337 1/20 0.35
ESR1 P03372 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
APLNR P35414 1/20 0.31
EPHX2 P34913 1/20 0.31
FFAR3 O14843 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
SCHEMBL16317267 0.86 VHL (0.33) POLBVHLSMN1; SMN2EPHX2
SCHEMBL19075667 0.79 RIPK1 (0.38)
SCHEMBL905280 0.75 HSD17B10 (0.42) SMN1; SMN2EPHX2
SCHEMBL16313201 0.74 DPP4 (0.34)
SCHEMBL23118976 0.73 MEN1 (0.33) ESR1MEN1KMT2AAPLNRFFAR3
SCHEMBL27671157 0.73 ESR1 (0.33) ESR1MEN1KMT2AAPLNRFFAR3
SCHEMBL27926042 0.71 KMT2A (0.36) ESR1MEN1KMT2AAPLNR
SCHEMBL23068014 0.71 ESR1 (0.31) ESR1MEN1KMT2AAPLNR
SCHEMBL14899050 0.69 ESR1 (0.30) ESR1MEN1KMT2A
SCHEMBL23897224 0.69 TP53 (0.32) VHLESR1MEN1KMT2A

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-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-07-06 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-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF RDX, C1R, MTX1 ATM 4395/4885POLB 2801/4885VHL 2858/4885

“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.