SCHEMBL30167005

SCHEMBL30167005

O=C(O)c1ccc2[nH]c(Cl)nc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.49
HSP90AA1 P07900 1/20 0.49
ESR2 Q92731 1/20 0.49
CHEK2 O96017 2/20 0.48
CDH1 P12830 1/20 0.46
APC P25054 1/20 0.46
CTNNB1 P35222 1/20 0.46
TCF7L2 Q9NQB0 1/20 0.46
SIRT2 Q8IXJ6 1/20 0.46
SIRT1 Q96EB6 1/20 0.46
KDM4E B2RXH2 4/20 0.46
RECQL P46063 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TSHR P16473 1/20 0.44
PRKAG1 P54619 1/20 0.44
PRKAA2 P54646 1/20 0.44
PRKAB1 Q9Y478 1/20 0.44
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43

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
SCHEMBL9928725 1.00 TDP1 (0.49) TDP1HSP90AA1ESR2CHEK2CDH1
SCHEMBL4076911 0.86 TDP1 (0.66) TDP1HSP90AA1ESR2CHEK2SMN1; SMN2
SCHEMBL9304008 0.85 CHEK2 (0.49) CHEK2THRBMEN1KMT2A
SCHEMBL828113 0.82 KDM4E (0.56) TDP1HSP90AA1ESR2CHEK2SIRT2
SCHEMBL12004550 0.82 KDM4E (0.49) TDP1HSP90AA1ESR2CHEK2CDH1
SCHEMBL1193316 0.81 RHEB (0.54) KDM4ESMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL1106071 0.79 TDP1 (0.76) TDP1HSP90AA1ESR2SIRT2SIRT1
SCHEMBL766092 0.79 TDP1 (0.49) TDP1HSP90AA1ESR2CHEK2SIRT2
SCHEMBL1870891 0.79 FABP6 (0.55) TDP1HSP90AA1ESR2SIRT2SIRT1
SCHEMBL9305228 0.79 TDP1 (0.49) TDP1HSP90AA1ESR2CHEK2SIRT2

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-115768761-B Novel benzimidazole derivatives 卡尔那生物科学株式会社 2025-02-25 CN disclosed
CN-115768761-A Novel benzimidazole derivatives 卡尔那生物科学株式会社 2023-03-07 CN disclosed