SCHEMBL18342004

SCHEMBL18342004

COc1ccc(Cn2c(=O)oc(=O)c3sccc32)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 2/20 0.57
FEN1 P39748 2/20 0.53
ALDH1A1 P00352 3/20 0.51
MAPT P10636 2/20 0.49
THRB P10828 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
POLB P06746 3/20 0.45
GAA P10253 1/20 0.45
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
P2RX4 Q99571 1/20 0.45
KDM4E B2RXH2 1/20 0.43
ALOX15 P16050 1/20 0.43
CMA1 P23946 1/20 0.43
PDE1B Q01064 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 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
SCHEMBL1522723 0.82 KMT2A (0.56) ERCC5FEN1ALDH1A1KMT2A
SCHEMBL1522863 0.80 FEN1 (0.54) ERCC5FEN1ALDH1A1KMT2A
SCHEMBL18341915 0.80 PDE1B (0.57) ERCC5FEN1ALDH1A1MAPTPOLB
SCHEMBL29119494 0.78 PDE1B (0.45) ERCC5FEN1ALDH1A1MAPTPOLB
SCHEMBL18341934 0.77 P2RX4 (0.48) ALDH1A1MAPTPOLBGAAMAPK1
SCHEMBL2860677 0.76 P2RX4 (0.68) ALDH1A1POLBGAAMAPK1SMN1; SMN2
SCHEMBL29859764 0.76 ERCC5 (0.61) ERCC5FEN1ALDH1A1MAPTTHRB
SCHEMBL2868888 0.76 MIF (0.46) ALDH1A1MAPTRXFP1POLBGAA
SCHEMBL2859999 0.74 KDM4E (0.53) ALDH1A1MAPTRXFP1POLBGAA
SCHEMBL1522996 0.74 GABRA1 (0.44) ERCC5FEN1ALDH1A1POLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116888127-A Tri-fused ring HPK1 inhibitor and application thereof 轩竹生物科技股份有限公司 2023-10-13 CN disclosed
WO-2022188823-A1 TRICYCLIC HPK1 INHIBITOR AND USE THEREOF 山东轩竹医药科技有限公司 2022-09-15 WO disclosed
US-20220002313-A1 HPK1 INHIBITORS AND METHODS OF USING SAME UNIVERSITY HEALTH NETWORK (CA) 2022-01-06 US disclosed
US-11059832-B2 HPK1 inhibitors and methods of using same UNIVERSITY HEALTH NETWORK (CA) 2021-07-13 US disclosed
EP-3322711-B1 HPK1 INHIBITORS AND METHODS OF USING SAME UNIV HEALTH NETWORK (CA) 2021-03-10 EP disclosed
US-20200190104-A1 HPK1 INHIBITORS AND METHODS OF USING SAME UNIVERSITY HEALTH NETWORK (CA) 2020-06-18 US disclosed
US-20180179221-A1 HPK1 INHIBITORS AND METHODS OF USING SAME UNIVERSITY HEALTH NETWORK (CA) 2018-06-28 US disclosed
EP-3322711-A1 HPK1 INHIBITORS AND METHODS OF USING SAME University Health Network (CA) 2018-05-23 EP disclosed
WO-2016205942-A1 HPK1 INHIBITORS AND METHODS OF USING SAME UNIVERSITY HEALTH NETWORK (CA) 2016-12-29 WO 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-11059832-B2 HPK1 inhibitors and methods of using same PDXK, PDK3, PDK2 ERCC5 843/4885FEN1 697/4885ALDH1A1 2442/4885
US-20180179221-A1 HPK1 INHIBITORS AND METHODS OF USING SAME PDXK, PDK3, PDK2 ERCC5 843/4885FEN1 697/4885ALDH1A1 2442/4885
US-20220002313-A1 HPK1 INHIBITORS AND METHODS OF USING SAME PDXK, PDK3, PDK2 ERCC5 806/4885FEN1 661/4885ALDH1A1 2458/4885
US-20200190104-A1 HPK1 INHIBITORS AND METHODS OF USING SAME PDXK, PDK3, PDK2 ERCC5 843/4885FEN1 697/4885ALDH1A1 2442/4885

“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.