SCHEMBL7252190

SCHEMBL7252190

O=C(Nc1ccc(Cl)c(C(=O)O)c1)Nc1ccccc1Br

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.65
MEN1 O00255 7/20 0.65
KMT2A Q03164 7/20 0.65
RAB9A P51151 7/20 0.65
MAPT P10636 4/20 0.65
SMN1; SMN2 Q16637 4/20 0.65
ALDH1A1 P00352 3/20 0.65
KDM4E B2RXH2 2/20 0.65
NFKB1 P19838 1/20 0.65
GFER P55789 1/20 0.65
NFKB2 Q00653 1/20 0.65
RELA Q04206 1/20 0.65
GRIK1 P39086 2/20 0.64
LMNA P02545 5/20 0.61
HTT P42858 3/20 0.61
CXCR2 P25025 4/20 0.56
CXCR1 P25024 3/20 0.56
DHODH Q02127 1/20 0.53
POLB P06746 1/20 0.53
GAA P10253 1/20 0.53

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
SCHEMBL6817281 0.82 MEN1 (0.67) NPC1MEN1KMT2ARAB9AMAPT
SCHEMBL27408754 0.81 KMT2A (0.60) NPC1MEN1KMT2ARAB9AMAPT
SCHEMBL1514839 0.79 MEN1 (1.00) NPC1MEN1KMT2ARAB9AMAPT
SCHEMBL3961520 0.78 GRIK1 (1.00) GRIK1CXCR2
SCHEMBL8746726 0.77 MEN1 (1.00) NPC1MEN1KMT2ARAB9AMAPT
SCHEMBL15798296 0.77 MEN1 (0.72) NPC1MEN1KMT2ARAB9AMAPT
SCHEMBL5188558 0.77 RAB9A (0.78) NPC1MEN1KMT2ARAB9AMAPT
SCHEMBL7254811 0.76 RAB9A (0.71) NPC1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL6260101 0.76 MEN1 (0.68) NPC1MEN1KMT2ARAB9AMAPT
SCHEMBL22103813 0.76 GRIK1 (0.63) NPC1MEN1KMT2ARAB9AMAPT

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-20030225125-A1 IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2003-12-04 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-20030225125-A1 IL-8 receptor antagonists CXCL8, CCR8, ACKR3 NPC1 2505/4885MEN1 4797/4885KMT2A 4312/4885

“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.