SCHEMBL8320432

SCHEMBL8320432

COc1ccc(CN2N=C(c3ccc(Cl)cc3)c3ccc(C)cc3-n3c(C)nnc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 17/20 0.44
BRD2 P25440 2/20 0.39
SMCHD1 A6NHR9 1/20 0.39
MYO1G B0I1T2 1/20 0.39
AIP O00170 1/20 0.39
AP3B1 O00203 1/20 0.39
PSMD11 O00231 1/20 0.39
CDC7 O00311 1/20 0.39
SAP18 O00422 1/20 0.39
KPNA3 O00505 1/20 0.39
PPP6C O00743 1/20 0.39
TCERG1 O14776 1/20 0.39
UBE2L6 O14933 1/20 0.39
PPP1R12A O14974 1/20 0.39
U2SURP O15042 1/20 0.39
SETD1A O15047 1/20 0.39
ARPC1B O15143 1/20 0.39
POLR1C O15160 1/20 0.39
OGT O15294 1/20 0.39
PPM1G O15355 1/20 0.39

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
SCHEMBL8318078 0.91 BRD4 (0.44) BRD4BRD2LMNABRD3MEN1
SCHEMBL8320603 0.88 BRD4 (0.48) BRD4BRD2LMNAHDAC1BRD3
SCHEMBL8322223 0.86 BRD4 (0.40) BRD4MEN1KMT2A
SCHEMBL8318824 0.85 BRD4 (0.45) BRD4BRD2LMNAHDAC1BRD3
SCHEMBL21847182 0.83 BRD4 (0.41) BRD4BRD2SMCHD1MYO1GAIP
SCHEMBL8318050 0.83 BRD4 (0.63) BRD4BRD2SMCHD1MYO1GAIP
SCHEMBL8317706 0.82 BRD4 (0.52) BRD4BRD2LMNAHDAC1BRD3
SCHEMBL8319389 0.81 BRD4 (0.46) BRD4BRD2SMCHD1MYO1GAIP
SCHEMBL8319404 0.81 BRD4 (0.47) BRD4BRD2BRD3NPC1RAB9A
SCHEMBL21847192 0.81 BRD4 (0.39) BRD4BRD2SMCHD1MYO1GAIP

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-0934940-A1 CYTOKINE PRODUCTION INHIBITORS, TRIAZEPINE COMPOUNDS, AND INTERMEDIATES THEREOF Japan Tobacco Inc. (JP) 1999-08-11 EP claimed
EP-0934940-A1 CYTOKINE PRODUCTION INHIBITORS, TRIAZEPINE COMPOUNDS, AND INTERMEDIATES THEREOF Japan Tobacco Inc. (JP) 1999-08-11 EP disclosed