SCHEMBL28067710

SCHEMBL28067710

Cc1ccccc1Sn1cnc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 4/20 0.46
▸ CYP11B2 P19099 4/20 0.46
▸ ASAH1 Q13510 1/20 0.42
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ HTT P42858 6/20 0.40
▸ LMNA P02545 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ STAT3 P40763 1/20 0.40
▸ TNF P01375 1/20 0.39
▸ HPGD P15428 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ ALDH3A1 P30838 1/20 0.38
▸ NOD1 Q9Y239 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ TSHR P16473 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
SCHEMBL1879818 0.75 HTT (0.48) CYP11B1CYP11B2ASAH1MEN1KMT2A
SCHEMBL6738639 0.75 POLB (0.46) ASAH1KMT2AHTTSMN1; SMN2POLB
SCHEMBL6381049 0.74 TDP1 (0.48) CYP11B1CYP11B2ASAH1MEN1KMT2A
SCHEMBL8013907 0.74 TDP1 (0.52) CYP11B1CYP11B2MEN1KMT2AMAPK1
SCHEMBL273486 0.74 TDP1 (0.52) CYP11B1CYP11B2MEN1KMT2AMAPK1
Toluene SCHEMBL28110598 0.71 CYP11B1 (0.47) CYP11B1CYP11B2ASAH1MEN1KMT2A
SCHEMBL10962344 0.71 POLB (0.49) CYP11B1CYP11B2MEN1KMT2ATDP1
SCHEMBL20683088 0.71 TDP1 (0.48) CYP11B1CYP11B2ASAH1MEN1KMT2A
SCHEMBL9060998 0.70 TDP1 (0.48) CYP11B1CYP11B2ASAH1MEN1KMT2A
SCHEMBL8412995 0.69 MEN1 (0.47) CYP11B1CYP11B2MEN1KMT2ATDP1

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
CN-105622580-B Benzimidazole as prolyl hydroxylase inhibitors 詹森药业有限公司 2019-06-21 — — CN disclosed
CN-105622580-A Benzoimidazoles as prolyl hydroxylase inhibitors JANSSEN PHARMACEUTICA NV 2016-06-01 — — CN disclosed
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