SCHEMBL30017647

SCHEMBL30017647

Clc1cc(Br)c2c(c1)NCCO2

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ EGFR P00533 2/20 0.33
▸ AR P10275 1/20 0.31
▸ RET P07949 1/20 0.31
▸ SIRT2 Q8IXJ6 1/20 0.30

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
SCHEMBL4475523 1.00 ALDH1A1 (0.35) ALDH1A1GAAMAPTHSD17B10EGFR
SCHEMBL24254608 0.79 ADRA2A (0.37) ALDH1A1GAAMAPTHSD17B10EGFR
SCHEMBL4481502 0.79 ALDH1A1 (0.50) ALDH1A1GAAMAPTHSD17B10EGFR
SCHEMBL13681643 0.77 ALDH1A1 (0.34) ALDH1A1GAAMAPTHSD17B10EGFR
SCHEMBL19433404 0.75 ALDH1A1 (0.35) ALDH1A1GAAMAPTHSD17B10EGFR
SCHEMBL17491542 0.75 AR (0.40) ALDH1A1GAAMAPTHSD17B10EGFR
SCHEMBL7275955 0.73 AKR1C4 (0.39) ALDH1A1MAPTHSD17B10RET
SCHEMBL3681573 0.72 ALDH1A1 (0.37) ALDH1A1GAAMAPTHSD17B10
SCHEMBL31731661 0.72 ALDH1A1 (0.37) ALDH1A1GAAMAPTHSD17B10
SCHEMBL13681607 0.70 AR (0.38) ALDH1A1GAAMAPTHSD17B10EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240287080-A1 O-LINKED THIADIAZOLYL COMPOUNDS AS DNA POLYMERASE THETA INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.4) LIMITED (GB) 2024-08-29 — — US disclosed
EP-4352055-A1 O-LINKED THIADIAZOLYL COMPOUNDS AS DNA POLYMERASE THETA INHIBITORS Ideaya Biosciences, Inc. (US) 2024-04-17 — — EP disclosed
WO-2022259204-A1 O-LINKED THIADIAZOLYL COMPOUNDS AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES, INC. (US) 2022-12-15 — — 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 (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-20240287080-A1 O-LINKED THIADIAZOLYL COMPOUNDS AS DNA POLYMERASE THETA INHIBITORS POLQ, POLK, POLB ALDH1A1 2542/4885GAA 1066/4885MAPT 3306/4885

“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.

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