SCHEMBL9302869

SCHEMBL9302869

CCC1(Cc2ccc(C(=O)N(C)C3CCCCC3)cc2)Nc2ccccc2N1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 1/20 0.48
HSD11B1 P28845 3/20 0.46
HPGD P15428 2/20 0.45
TSHR P16473 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HSD11B2 P80365 1/20 0.44
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ACACB O00763 1/20 0.42
POLB P06746 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
CNR2 P34972 1/20 0.40
PDK2 Q15119 1/20 0.40
HRH3 Q9Y5N1 2/20 0.39
AGER Q15109 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
SCHEMBL9302156 0.91 PTAFR (0.48) PTAFRHSD11B1HPGDTSHRMEN1
SCHEMBL9301613 0.87 PTAFR (0.50) PTAFRHSD11B1HPGDTSHRMEN1
SCHEMBL9303318 0.87 PTAFR (0.45) PTAFRHSD11B1HPGDTSHRMEN1
SCHEMBL9301925 0.83 PTAFR (0.47) PTAFRHSD11B1HPGDTSHRMEN1
SCHEMBL9301794 0.83 HSD11B1 (0.48) PTAFRHSD11B1HPGDTSHRMEN1
SCHEMBL9305054 0.83 PTAFR (0.47) PTAFRHSD11B1HPGDTSHRMEN1
SCHEMBL9301708 0.83 HSD11B1 (0.47) PTAFRHSD11B1HPGDTSHRMEN1
SCHEMBL9302761 0.83 PDK2 (0.47) PTAFRHSD11B1HPGDTSHRMEN1
SCHEMBL9303513 0.82 HPGD (0.49) PTAFRHSD11B1HPGDTSHRMEN1
SCHEMBL9302553 0.82 PTAFR (0.46) PTAFRHSD11B1HPGDTSHRMEN1

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-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
EP-0468971-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-02-05 EP disclosed
WO-1990009997-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-09-07 WO disclosed