SCHEMBL23915388

SCHEMBL23915388

CCOC(=O)Cc1n[nH]c(=O)c2cccc(Br)c12

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.69
ALDH1A1 P00352 2/20 0.69
POLB P06746 2/20 0.48
TSHR P16473 1/20 0.45
RECQL P46063 1/20 0.44
PARP1 P09874 1/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42
PKM P14618 1/20 0.41

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
SCHEMBL5010738 0.82 SMN1; SMN2 (1.00) SMN1; SMN2ALDH1A1POLBTSHRRECQL
SCHEMBL6305189 0.80 PARP1 (0.46) SMN1; SMN2ALDH1A1POLBPARP1LMNA
SCHEMBL11163548 0.80 SMN1; SMN2 (0.72) SMN1; SMN2ALDH1A1POLBTSHRRECQL
SCHEMBL11173101 0.78 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1POLBRECQLPARP1
SCHEMBL23908895 0.77 SMN1; SMN2 (0.70) SMN1; SMN2ALDH1A1POLBTSHRPARP1
SCHEMBL23914881 0.74 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1POLBTSHRRECQL
SCHEMBL15866096 0.73 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1RECQLKDM4ELMNA
SCHEMBL1989361 0.72 SMN1; SMN2 (0.72) SMN1; SMN2ALDH1A1POLBRECQLKDM4E
SCHEMBL25310305 0.72 ALDH1A1 (0.76) SMN1; SMN2ALDH1A1POLBTSHRPARP1
SCHEMBL9674963 0.72 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1POLBPARP1KDM4E

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 2920/4885ALDH1A1 944/4885POLB 3606/4885

“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.