SCHEMBL259213

SCHEMBL259213

O=c1[nH]c(-c2ccccc2)nc2c1sc1ncccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.57
TNKS O95271 6/20 0.55
TNKS2 Q9H2K2 6/20 0.55
KRAS P01116 1/20 0.55
PARP1 P09874 3/20 0.49
ALDH1A1 P00352 6/20 0.48
KDM4E B2RXH2 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
GAA P10253 2/20 0.48
RAB9A P51151 2/20 0.48
PARP2 Q9UGN5 1/20 0.46
PIK3CA P42336 1/20 0.46
HPGD P15428 3/20 0.45
LIMK1 P53667 1/20 0.45
MAPT P10636 3/20 0.45
ALOX15 P16050 1/20 0.45
HSD17B10 Q99714 1/20 0.45
APOBEC3G Q9HC16 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44
NPC1 O15118 1/20 0.44

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
SCHEMBL1074928 0.86 KRAS (0.46) CHEK1TNKSTNKS2KRASPARP1
SCHEMBL23378336 0.80 LIMK1 (0.55) CHEK1TNKSTNKS2KRASPARP1
SCHEMBL259202 0.77 PARP1 (0.53) TNKSTNKS2KRASPARP1ALDH1A1
SCHEMBL23378412 0.76 LIMK1 (0.48) TNKSTNKS2KRASALDH1A1KDM4E
SCHEMBL23378452 0.73 LIMK1 (0.42) KRASKDM4EPIK3CALIMK1CLK1
SCHEMBL23378173 0.73 LIMK1 (0.41) KRASKDM4EPIK3CALIMK1CLK1
SCHEMBL278692 0.72 CDC7 (0.51) TNKS2PARP1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL5438893 0.71 TNKS (0.65) TNKSTNKS2PARP1ALDH1A1SMN1; SMN2
SCHEMBL259214 0.71 TNKS (0.49) TNKSTNKS2PARP1ALDH1A1KDM4E
SCHEMBL23378544 0.70 PIK3CA (0.59) ALDH1A1KDM4ESMN1; SMN2RAB9APIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230084927-A1 GLUCOSE UPTAKE INHIBITORS AND USES THEREOF METABOMED LTD. (IL) 2023-03-16 US disclosed
EP-4058027-A1 GLUCOSE UPTAKE INHIBITORS AND USES THEREOF Metabomed Ltd (IL) 2022-09-21 EP disclosed
WO-2021095032-A1 GLUCOSE UPTAKE INHIBITORS AND USES THEREOF METABOMED LTD (IL) 2021-05-20 WO disclosed
WO-2021095032-A1 GLUCOSE UPTAKE INHIBITORS AND USES THEREOF METABOMED LTD (IL) 2021-05-20 WO disclosed
US-8067586-B2 Fused heteroaryl derivatives ASTELLAS PHARMA INC. (JP) 2011-11-29 US disclosed
US-8067586-B2 Fused heteroaryl derivatives ASTELLAS PHARMA INC. (JP) 2011-11-29 US disclosed
US-20100137584-A1 FUSED HETEROARYL DERIVATIVES HAYAKAWA MASAHIKO 2010-06-03 US disclosed
US-20100137584-A1 FUSED HETEROARYL DERIVATIVES HAYAKAWA MASAHIKO 2010-06-03 US disclosed
US-20100137585-A1 FUSED HETEROARYL DERIVATIVES HAYAKAWA MASAHIKO 2010-06-03 US disclosed
US-20100137585-A1 FUSED HETEROARYL DERIVATIVES HAYAKAWA MASAHIKO 2010-06-03 US disclosed
US-20070037805-A1 Fused heteroaryl derivatives HAYAKAWA MASAHIKO 2007-02-15 US disclosed
US-20070037805-A1 Fused heteroaryl derivatives HAYAKAWA MASAHIKO 2007-02-15 US disclosed
US-7173029-B2 Fused heteroaryl derivatives ASTELLAS PHARMA INC. (JP) 2007-02-06 US disclosed
US-7173029-B2 Fused heteroaryl derivatives ASTELLAS PHARMA INC. (JP) 2007-02-06 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 (4 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-20100137584-A1 FUSED HETEROARYL DERIVATIVES PIK3CD, PIK3R3, PIK3C2A CHEK1 326/4885TNKS 578/4885TNKS2 487/4885
US-20070037805-A1 Fused heteroaryl derivatives PIK3CD, PIK3R3, PIK3C2A CHEK1 326/4885TNKS 578/4885TNKS2 487/4885
US-20100137585-A1 FUSED HETEROARYL DERIVATIVES PIK3CD, PIK3R3, PIK3C2A CHEK1 326/4885TNKS 578/4885TNKS2 487/4885
US-20230084927-A1 GLUCOSE UPTAKE INHIBITORS AND USES THEREOF SLC2A4, SLC2A1, SLC2A2 CHEK1 378/4885TNKS 2991/4885TNKS2 2927/4885

“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.