SCHEMBL19083694

SCHEMBL19083694

CC(=O)N1C(C(=O)O)CCC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.36
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ APLNR P35414 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ APEX1 P27695 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ EPHX2 P34913 1/20 0.31
▸ SLC1A2 P43004 2/20 0.31
▸ SLC1A1 P43005 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ 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
SCHEMBL16316616 0.86 SMN1; SMN2 (0.32) SMN1; SMN2EPHX2
SCHEMBL19075576 0.79 LMNA (0.34) KMT2AHSD17B10
SCHEMBL19616822 0.75 HSD17B10 (0.39) SMN1; SMN2HSD17B10
SCHEMBL1579022 0.75 HSD17B10 (0.39) SMN1; SMN2HSD17B10
SCHEMBL13532919 0.75 KMT2A (0.35) ATMKMT2ASMN1; SMN2APLNRSLC1A2
SCHEMBL1440834 0.73 SMN1; SMN2 (0.32) ATMSMN1; SMN2ALDH1A1
SCHEMBL14158149 0.71 LMNA (0.39) ATMSMN1; SMN2POLBALDH1A1
SCHEMBL19839027 0.71 ATM (0.30) ATM
SCHEMBL12469673 0.71 CNR2 (0.37) SLC1A2SLC1A1
SCHEMBL23194386 0.67 TSHR (0.31) —

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-3166939-B1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH INC (US) 2019-06-05 — — EP disclosed
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 4395/4885KMT2A 1836/4885SMN1; SMN2 2803/4885

“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.

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