SCHEMBL9119941

SCHEMBL9119941

O=c1[nH]c2ccccc2n1-c1cc(Cl)ccc1O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 8/20 0.75
KDM4E B2RXH2 2/20 0.56
HTT P42858 2/20 0.56
LMNA P02545 3/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
MAPT P10636 2/20 0.51
GAA P10253 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
TSHR P16473 1/20 0.51
NFKB1 P19838 1/20 0.51
CYP2C19 P33261 1/20 0.51
BLM P54132 1/20 0.51
PMP22 Q01453 1/20 0.51
KCNMA1 Q12791 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
AURKA O14965 2/20 0.49

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
SCHEMBL5631019 0.88 HSP90AA1 (0.60) HSP90AA1KDM4EHTTLMNAMEN1
SCHEMBL5436491 0.83 HSP90AA1 (0.71) HSP90AA1KDM4EHTTLMNAMEN1
SCHEMBL5434988 0.83 HSP90AA1 (0.71) HSP90AA1KDM4EHTTLMNAMEN1
SCHEMBL9118401 0.83 HSP90AA1 (0.56) HSP90AA1KDM4EHTTLMNAMEN1
SCHEMBL5434927 0.83 HSP90AA1 (1.00) HSP90AA1KDM4EHTTMEN1KMT2A
SCHEMBL5433741 0.83 HSP90AA1 (0.70) HSP90AA1KDM4EHTTLMNAMEN1
SCHEMBL10559676 0.82 KDM4E (0.74) HSP90AA1KDM4EHTTLMNAMEN1
SCHEMBL9116312 0.82 HSP90AA1 (0.57) HSP90AA1KDM4EHTTLMNAMEN1
SCHEMBL9119308 0.82 HSP90AA1 (0.72) HSP90AA1KDM4ELMNAMEN1KMT2A
SCHEMBL9118502 0.82 HSP90AA1 (0.65) HSP90AA1KDM4EHTTLMNAMEN1

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