SCHEMBL23915567

SCHEMBL23915567

Cc1nn(CC(=O)OC(C)(C)C)c(=O)c2ccccc12

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.64
NPSR1 Q6W5P4 2/20 0.61
RAB9A P51151 1/20 0.61
SMN1; SMN2 Q16637 2/20 0.57
POLB P06746 1/20 0.55
HTT P42858 2/20 0.54
TSHR P16473 1/20 0.54
KMT2A Q03164 2/20 0.54
MAPK1 P28482 1/20 0.53
GAA P10253 1/20 0.52

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
SCHEMBL13329858 0.85 KDM4E (0.50) LMNANPSR1RAB9ASMN1; SMN2HTT
SCHEMBL23909061 0.83 ALOX15 (0.53) LMNANPSR1TSHRKMT2AGAA
SCHEMBL23909094 0.82 MAPT (0.64) POLBTSHRKMT2A
SCHEMBL11985505 0.82 LMNA (0.69) LMNANPSR1RAB9ASMN1; SMN2POLB
SCHEMBL23966512 0.81 ALOX15 (0.51) RAB9APOLBTSHRGAA
SCHEMBL23909042 0.81 TSHR (0.55) SMN1; SMN2TSHRKMT2A
SCHEMBL6885992 0.81 LMNA (0.77) LMNANPSR1RAB9ASMN1; SMN2POLB
SCHEMBL28377237 0.80 ALOX15 (0.56) LMNARAB9ATSHRKMT2AGAA
SCHEMBL12301768 0.80 LMNA (0.75) LMNANPSR1RAB9ASMN1; SMN2POLB
SCHEMBL18171832 0.78 KDM4E (0.48) LMNAPOLBTSHRKMT2A

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-3649119-B1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GALAPAGOS NV (BE) 2021-11-03 EP disclosed
US-20210315893-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GILEAD SCIENCES, INC. 2021-10-14 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-20210315893-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS S1PR1, S1PR3, S1PR2 LMNA 449/4885NPSR1 143/4885RAB9A 2691/4885

“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.