SCHEMBL19924948

SCHEMBL19924948

COc1c(F)cc(CBr)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
HTR2A P28223 5/20 0.36
HTR2C P28335 5/20 0.36
DBH P09172 2/20 0.36
HTR1A P08908 2/20 0.36
DRD2 P14416 2/20 0.36
DRD4 P21917 2/20 0.36
DRD3 P35462 2/20 0.36
HTR2B P41595 3/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 3/20 0.35
GAA P10253 3/20 0.35
MAPT P10636 2/20 0.35
PTGS2 P35354 2/20 0.34
HTT P42858 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM1A O60341 1/20 0.33

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
SCHEMBL6941573 0.86 ALDH1A1 (0.44) KMT2AMEN1HTR2AHTR2CDBH
SCHEMBL3769931 0.86 DBH (0.44) HTR2AHTR2CDBHHTR2BMAPT
SCHEMBL15109247 0.83 DRD2 (0.50) KMT2AMEN1HTR2AHTR2CDBH
SCHEMBL16411029 0.81 HTR2A (0.39) KMT2AMEN1HTR2AHTR2CDBH
SCHEMBL16411031 0.81 THRB (0.44) KMT2AMEN1HTR2AHTR2CDBH
SCHEMBL31063514 0.79 CA2 (0.41) KMT2AMEN1HTR2AHTR2CDBH
SCHEMBL3794626 0.79 CA2 (0.41) KMT2AMEN1HTR2AHTR2CDBH
SCHEMBL4834596 0.79 HTR2A (0.42) KMT2AMEN1HTR2AHTR2CDBH
SCHEMBL30538460 0.77
SCHEMBL15271622 0.75 ACLY (0.41) ALDH1A1KDM4EGAAMAPTPTGS2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3507281-A1 IMIDAZOLE DERIVATIVES AND THEIR USE IN THE TREATMENT OF AUTOIMMUNE OR INFLAMMATORY DISEASES OR CANCERS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2019-07-10 EP disclosed
US-20190202799-A1 IMIDAZOLE DERIVATIVES AND THEIR USE IN THE TREATMENT OF AUTOIMMUNE OR INFLAMMATORY DISEASES OR CANCERS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2019-07-04 US disclosed
WO-2018041964-A1 IMIDAZOLE DERIVATIVES AND THEIR USE IN THE TREATMENT OF AUTOIMMUNE OR INFLAMMATORY DISEASES OR CANCERS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2018-03-08 WO 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-20190202799-A1 IMIDAZOLE DERIVATIVES AND THEIR USE IN THE TREATMENT OF AUTOIMMUNE OR INFLAMMATORY DISEASES OR CANCERS BRD4, BRPF3, BRD3 KMT2A 251/4885MEN1 756/4885HTR2A 4799/4885

“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.