SCHEMBL9303513

SCHEMBL9303513

CN(C(=O)c1ccc(CC2(c3ccccc3Cl)Nc3ccccc3N2)cc1)C1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.49
TSHR P16473 1/20 0.49
HSD11B1 P28845 3/20 0.47
PTAFR P25105 1/20 0.46
HSD11B2 P80365 1/20 0.45
PDK2 Q15119 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
AGER Q15109 1/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
HTT P42858 1/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ACACB O00763 1/20 0.39
POLB P06746 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
MAPT P10636 1/20 0.39
TP53 P04637 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
SCHEMBL9301925 0.85 PTAFR (0.47) HPGDTSHRHSD11B1PTAFRHSD11B2
SCHEMBL9301613 0.83 PTAFR (0.50) HPGDTSHRHSD11B1PTAFRHSD11B2
SCHEMBL9302869 0.82 PTAFR (0.48) HPGDTSHRHSD11B1PTAFRHSD11B2
SCHEMBL9671899 0.81 HPGD (0.50) HPGDTSHRHSD11B1PTAFRHSD11B2
SCHEMBL9302156 0.80 PTAFR (0.48) HPGDTSHRHSD11B1PTAFRHSD11B2
SCHEMBL9302553 0.80 PTAFR (0.46) HPGDTSHRHSD11B1PTAFRHSD11B2
SCHEMBL9301794 0.79 HSD11B1 (0.48) HPGDTSHRHSD11B1PTAFRHSD11B2
SCHEMBL9305054 0.79 PTAFR (0.47) HPGDTSHRHSD11B1PTAFRHSD11B2
SCHEMBL9302142 0.79 PTAFR (0.44) HPGDTSHRHSD11B1PTAFRHSD11B2
SCHEMBL9302761 0.78 PDK2 (0.47) HPGDTSHRHSD11B1PTAFRHSD11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0468971-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-02-05 EP claimed
WO-1990009997-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-09-07 WO claimed
US-5314880-A Platelet activating factor antagonist BRITISH BIO-TECHNOLOGY LIMITED (GB) 1994-05-24 US disclosed
WO-1990009997-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-09-07 WO disclosed