SCHEMBL19985015

SCHEMBL19985015

Cc1ccc(NC(=O)[C@@H](N)c2ccccc2)c(Br)c1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.62
RAB9A P51151 5/20 0.62
NPC1 O15118 4/20 0.62
KMT2A Q03164 7/20 0.53
MEN1 O00255 5/20 0.53
MAPT P10636 6/20 0.53
TP53 P04637 1/20 0.53
GAA P10253 2/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
ALDH1A1 P00352 3/20 0.49
HPGD P15428 3/20 0.49
NPSR1 Q6W5P4 1/20 0.46
OGT O15294 1/20 0.46
POLB P06746 3/20 0.46
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL16098100 1.00 SMN1; SMN2 (0.62) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL6717088 0.86 MEN1 (0.56) SMN1; SMN2RAB9AKMT2AMEN1MAPT
SCHEMBL17378285 0.83 KMT2A (0.53) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL6718886 0.83 BRD4 (0.62) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL1703978 0.77 RAB9A (0.68) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL12218189 0.77 RAB9A (1.00) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL17364129 0.76 NPC1 (0.50) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL6717100 0.76 ALDH1A1 (0.63) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL6717109 0.76 ALDH1A1 (0.63) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL6718773 0.76 RAB9A (0.55) SMN1; SMN2RAB9ANPC1MAPTGAA

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-20180079730-A1 ANTI-PCSK9 COMPOUNDS AND METHODS FOR THE TREATMENT AND/OR PREVENTION OF CARDIOVASCULAR DISEASES SHIFA BIOMEDICAL CORP (US) 2018-03-22 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-20180079730-A1 ANTI-PCSK9 COMPOUNDS AND METHODS FOR THE TREATMENT AND/OR PREVENTION OF CARDIOVASCULAR DISEASES PCSK9, PCSK7, PCSK6 SMN1; SMN2 4600/4885RAB9A 2189/4885NPC1 53/4885

“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.