SCHEMBL9118532

SCHEMBL9118532

COc1ccccc1-n1c(=O)[nH]c2c(OC)cccc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.61
KDM4E B2RXH2 6/20 0.48
MAPT P10636 4/20 0.48
ALDH1A1 P00352 4/20 0.48
HPGD P15428 3/20 0.48
HTT P42858 1/20 0.48
MGLL Q99685 1/20 0.45
SLC2A1 P11166 1/20 0.45
SLC2A3 P11169 1/20 0.45
PKM P14618 1/20 0.44
HSD17B10 Q99714 1/20 0.44
NQO2 P16083 1/20 0.43
GLA P06280 2/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TSHR P16473 1/20 0.43
HTR7 P34969 1/20 0.43
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL7477638 0.85 DAO (0.61) DAOKDM4EMAPTALDH1A1HPGD
SCHEMBL7479392 0.83 HTR7 (0.55) KDM4EMAPTALDH1A1HPGDMGLL
SCHEMBL194512 0.78 DAO (0.69) DAOKDM4EMAPTALDH1A1HPGD
SCHEMBL3975023 0.75 MGLL (0.55) KDM4EMAPTALDH1A1HPGDHTT
SCHEMBL6981145 0.75 HSD17B10 (0.74) KDM4EMAPTALDH1A1HPGDHTT
SCHEMBL9118924 0.74 ALDH1A1 (0.50) KDM4EMAPTALDH1A1HPGDHTT
SCHEMBL12792523 0.74 DAO (0.63) DAOKDM4EMAPTALDH1A1HPGD
SCHEMBL11689735 0.73 HSD17B10 (0.48) KDM4EMAPTALDH1A1HPGDHTT
SCHEMBL28181208 0.73 MGLL (0.47) KDM4EMAPTALDH1A1HPGDHTT
SCHEMBL3150761 0.71 DAO (0.60) DAOMAPTMGLLHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0477819-B1 Benzimidazole derivatives, their preparation and use NEUROSEARCH AS (DK) 1995-03-15 EP disclosed
US-5200422-A Benzimidazole derivatives, their preparation and use NEUROSEARCH A/S (DK) 1993-04-06 US disclosed
EP-0477819-A2 Benzimidazole derivatives, their preparation and use NEUROSEARCH A/S (DK) 1992-04-01 EP disclosed