SCHEMBL23914636

SCHEMBL23914636

CC(C)(C)OC(=O)N1CCC(n2nc(CC(=O)O)c3ccccc3c2=O)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.50
LMNA P02545 2/20 0.50
NPC1 O15118 1/20 0.50
NR2F2 P24468 1/20 0.50
HTT P42858 1/20 0.50
GPR119 Q8TDV5 3/20 0.47
MAPT P10636 1/20 0.46
POLB P06746 1/20 0.46
ADRA1A P35348 3/20 0.45
HRH1 P35367 3/20 0.45
ADRA1B P35368 3/20 0.45
HRH3 Q9Y5N1 2/20 0.45
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.45
PKM P14618 1/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
DTYMK P23919 1/20 0.44
S1PR2 O95136 1/20 0.43
STS P08842 1/20 0.43

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
SCHEMBL23909121 0.94 NPC1 (0.47) SMN1; SMN2LMNANPC1NR2F2HTT
SCHEMBL23914934 0.90 LMNA (0.51) SMN1; SMN2LMNANPC1NR2F2HTT
SCHEMBL23914926 0.90 MAPT (0.48) SMN1; SMN2LMNANPC1NR2F2HTT
SCHEMBL23966858 0.88 LMNA (0.46) SMN1; SMN2LMNANPC1NR2F2HTT
SCHEMBL23908931 0.84 NPC1 (0.47) SMN1; SMN2LMNANPC1NR2F2HTT
SCHEMBL23913676 0.84 MAPT (0.53) SMN1; SMN2LMNANPC1NR2F2HTT
SCHEMBL2995095 0.84 ADRA1A (0.69) SMN1; SMN2LMNAADRA1AHRH1ADRA1B
SCHEMBL23909085 0.82 MAPT (0.58) MAPTPOLBADRA1AHRH1ADRA1B
SCHEMBL2820393 0.81 ADRA1A (0.68) SMN1; SMN2LMNAADRA1AHRH1ADRA1B
SCHEMBL23915443 0.81 MAPT (0.51) SMN1; SMN2LMNANPC1NR2F2HTT

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 SMN1; SMN2 2920/4885LMNA 449/4885NPC1 467/4885

“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.