SCHEMBL19924907

SCHEMBL19924907

Brc1cn(Cc2ccccc2)c(Br)n1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.49
CYP11B1 P15538 3/20 0.41
CYP11B2 P19099 3/20 0.41
TNF P01375 1/20 0.41
IDO1 P14902 1/20 0.40
CYP19A1 P11511 2/20 0.39
ALDH1A1 P00352 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
P2RX7 Q99572 2/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
ADRA1D P25100 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
RECQL P46063 1/20 0.37
DBH P09172 1/20 0.37

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
SCHEMBL16828803 0.81 BRD4 (0.53) BRD4TNFKDM4EP2RX7
SCHEMBL28717264 0.80 BRD4 (0.49) BRD4CYP11B1CYP11B2IDO1CYP19A1
SCHEMBL21553055 0.79 BRD4 (0.54) BRD4ALDH1A1KDM4EP2RX7
SCHEMBL29502155 0.75 SMN1; SMN2 (0.48) BRD4CYP11B1CYP11B2ALDH1A1
SCHEMBL17166094 0.75 TSHR (0.46) BRD4L3MBTL1P2RX7ADRA1D
SCHEMBL19924926 0.75 SOS1 (0.51) CYP19A1ALDH1A1
SCHEMBL29278376 0.74 BRD4 (0.47) BRD4ALDH1A1L3MBTL1KDM4E
SCHEMBL31132828 0.73 BRD4 (0.52) BRD4P2RX7
SCHEMBL29502126 0.72 TLR8 (0.47) BRD4ALDH1A1KDM4EADORA2AADORA1
SCHEMBL29502238 0.71 TP53 (0.50) BRD4CYP11B1CYP11B2ALDH1A1L3MBTL1

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 5 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
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
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 BRD4 1/4885CYP11B1 2425/4885CYP11B2 3217/4885

“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.