SCHEMBL9302831

SCHEMBL9302831

CC1(Cc2ccc(C(=O)N(C3CCCCC3)C3CCCCC3)cc2)Nc2ccccc2N1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
MAPT P10636 1/20 0.52
HTT P42858 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
ALOX15 P16050 1/20 0.48
ALOX12 P18054 1/20 0.48
RECQL P46063 1/20 0.48
ADAM17 P78536 1/20 0.48
KMT2A Q03164 1/20 0.48
HSD11B1 P28845 4/20 0.45
SLC6A4 P31645 4/20 0.43
SLC6A2 P23975 3/20 0.42
SLC6A3 Q01959 3/20 0.42
AGER Q15109 3/20 0.42
MTNR1A P48039 1/20 0.42
ADORA2A P29274 1/20 0.42
S1PR1 P21453 1/20 0.41
CHRM4 P08173 1/20 0.40

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
SCHEMBL9303761 0.90 HSD11B1 (0.50) LMNAMAPTHTTNPSR1MEN1
SCHEMBL9301613 0.89 PTAFR (0.50) MEN1KMT2AHSD11B1AGERMTNR1A
SCHEMBL9302156 0.77 PTAFR (0.48) MEN1KMT2AHSD11B1AGERMTNR1A
SCHEMBL9302869 0.77 PTAFR (0.48) MEN1KMT2AHSD11B1AGERPTAFR
SCHEMBL9302553 0.77 PTAFR (0.46) LMNAMAPTHTTNPSR1MEN1
SCHEMBL9305054 0.76 PTAFR (0.47) MEN1KMT2AHSD11B1PTAFR
SCHEMBL9301925 0.76 PTAFR (0.47) LMNAMAPTHTTNPSR1MEN1
SCHEMBL9301794 0.76 HSD11B1 (0.48) MEN1KMT2AHSD11B1PTAFR
SCHEMBL9302515 0.76 ALDH1A1 (0.44) LMNAHTTNPSR1KDM4EMEN1
SCHEMBL9302761 0.75 PDK2 (0.47) MEN1KMT2AHSD11B1AGERMTNR1A

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