SCHEMBL9989122

SCHEMBL9989122

CNC(=O)c1ccc2c[nH]nc2c1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 3/20 0.48
THRB P10828 1/20 0.48
PLAU P00749 1/20 0.47
CCNC P24863 4/20 0.46
CDK8 P49336 4/20 0.46
TDP1 Q9NUW8 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
HPGDS O60760 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
MMP13 P45452 1/20 0.42
ITK Q08881 1/20 0.42
HDAC8 Q9BY41 2/20 0.42
HDAC6 Q9UBN7 2/20 0.42
HDAC2 Q92769 1/20 0.42
CHEK2 O96017 3/20 0.41

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
SCHEMBL25402169 0.85 HDAC6 (0.46) HDAC8HDAC6HDAC2
SCHEMBL27061741 0.84 TP53 (0.47) SMN1; SMN2HPGDSHPGD
SCHEMBL25753506 0.83 MAPT (0.50) SMN1; SMN2HPGDSCHEK2
SCHEMBL21730148 0.82 KDM4E (0.50) TDP1SMN1; SMN2HPGDHTT
SCHEMBL25401469 0.80 TDP1 (0.53) THRBTDP1SMN1; SMN2HPGDHTT
SCHEMBL17112019 0.79 RAB9A (0.56) PLAUSMN1; SMN2HPGDHTTHDAC8
SCHEMBL1725437 0.78 LCK (0.46) HPGDSMMP13CHEK2
Hydrochloric Acid SCHEMBL31386777 0.77 LCK (0.44) HPGDSMMP13CHEK2
SCHEMBL9989116 0.76 NPC1 (0.60) SMN1; SMN2HPGDSHTT
SCHEMBL27062550 0.75 ALDH1A1 (0.34) TDP1SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023220440-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2023-11-16 WO disclosed
WO-2023091644-A2 HSD17B13-RELATED DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2023-05-25 WO disclosed
WO-2022099159-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2022-05-12 WO disclosed
WO-2021234459-A9 DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2022-02-03 WO disclosed
WO-2021234459-A2 DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2021-11-25 WO disclosed
WO-2021237223-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2021-11-25 WO disclosed
US-20110319379-A1 Substituted Indazole Amides And Their Use As Glucokinase Activators CORBETT JEFFREY W (US) 2011-12-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110319379-A1 Substituted Indazole Amides And Their Use As Glucokinase Activators GCKR, GCK, GALK1 PLK1 3725/4885THRB 1701/4885PLAU 2126/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.