SCHEMBL25544916

SCHEMBL25544916

Cc1ncc(-c2nccs2)cc1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 1/20 0.44
CHEK2 O96017 1/20 0.44
PDPK1 O15530 1/20 0.42
SMPD3 Q9NY59 1/20 0.41
CYP2A6 P11509 2/20 0.38
ECE1 P42892 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
TRPM4 Q8TD43 1/20 0.38
ABL1 P00519 3/20 0.37
BCR P11274 3/20 0.37
KDM4E B2RXH2 1/20 0.37
KMT2A Q03164 1/20 0.37
ACLY P53396 1/20 0.37
HDAC2 Q92769 1/20 0.37
F2 P00734 1/20 0.36
F10 P00742 1/20 0.36
PLG P00747 1/20 0.36
F7 P08709 1/20 0.36
F3 P13726 1/20 0.36
ADRB2 P07550 1/20 0.36

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
SCHEMBL3722096 0.76 TRPM4 (0.47) CHEK2PDPK1PTGDR2TRPM4ABL1
SCHEMBL25544923 0.76 CHEK2 (0.55) PIK3C3CHEK2CYP2A6
SCHEMBL25544881 0.75 KDM4E (0.54) PIK3C3CHEK2KDM4EKMT2A
SCHEMBL17619558 0.74 PDPK1 (0.43) CHEK2PDPK1SMPD3CYP2A6KDM4E
SCHEMBL25544940 0.73 PIK3C3 (0.44) PIK3C3KDM4EKMT2A
SCHEMBL3218092 0.73 HPGD (0.46) PDPK1ECE1KDM4EKMT2A
SCHEMBL26643045 0.73 ECE1 (0.44) PDPK1SMPD3ECE1KDM4EKMT2A
SCHEMBL2322786 0.72 LDHA (0.54) PIK3C3
SCHEMBL3350408 0.72 SMPD3 (0.46) CHEK2PDPK1SMPD3CYP2A6ECE1
Hydrochloric Acid SCHEMBL3528772 0.71 LDHA (0.53) PIK3C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230150997-A1 EIF4E INHIBITORS AND USES THEREOF PIC Therapeutics, Inc. 2023-05-18 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-20230150997-A1 EIF4E INHIBITORS AND USES THEREOF EIF4E, EIF4EBP1, EIF4A1 PIK3C3 478/4885CHEK2 1736/4885PDPK1 802/4885

“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.