SCHEMBL7817673

SCHEMBL7817673

O=C(O)c1[nH]c2cccc(OCCBr)c2c1Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 15/20 0.48
GPR17 Q13304 2/20 0.42
BCL2 P10415 4/20 0.41
ALB P02768 1/20 0.41
BCL2L1 Q07817 1/20 0.41
GRIN1 Q05586 1/20 0.38

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
Ethyne SCHEMBL7605585 0.70 GPR17 (0.45) GPR17GRIN1
SCHEMBL7817672 0.69 MEN1 (0.50)
SCHEMBL7592453 0.68 GPR35 (0.43) GPR17
SCHEMBL7463695 0.67 SLC6A2 (0.41) MCL1GPR17GRIN1
SCHEMBL7072708 0.67 GPR17 (0.61) MCL1GPR17BCL2
SCHEMBL7076761 0.66 MCL1 (0.48) MCL1GPR17BCL2
SCHEMBL5214867 0.66 ALOX5 (0.47)
SCHEMBL7842628 0.65 KDM4E (0.47) MCL1BCL2
SCHEMBL27873446 0.65 PTPRG (0.56)
SCHEMBL7074273 0.65 MDM2 (0.40) MCL1GPR17

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-1150954-A1 ANTI-IMFLAMMATORY INDOLE DERIVATIVES AstraZeneca AB (SE) 2001-11-07 EP disclosed
WO-2000046198-A1 ANTI-INFLAMMATORY INDOLE DERIVATIVES ASTRAZENECA AB (SE) 2000-08-10 WO disclosed