SCHEMBL22717753

SCHEMBL22717753

Nc1nnc(OCc2ccc(Cl)nc2)s1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.41
▸ POLB P06746 3/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ MGMT P16455 1/20 0.38
▸ MGAM O43451 2/20 0.38
▸ GAA P10253 2/20 0.38
▸ SI P14410 2/20 0.38
▸ MGAM2 Q2M2H8 2/20 0.38
▸ PTGS1 P23219 1/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ CHRNA1 P02708 1/20 0.38
▸ CHRNB2 P17787 1/20 0.38
▸ CHRNA3 P32297 1/20 0.38
▸ CHRNA7 P36544 1/20 0.38
▸ CHRNA4 P43681 1/20 0.38
▸ HTT P42858 1/20 0.37

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
SCHEMBL29574301 1.00 ALDH1A1 (0.41) ALDH1A1POLBNPC1RAB9AMEN1
SCHEMBL22717882 0.83 ALDH1A1 (0.54) ALDH1A1POLBMEN1KMT2AMGAM
SCHEMBL22717405 0.83 ALDH1A1 (0.54) ALDH1A1POLBMEN1KMT2AMGAM
SCHEMBL29574595 0.77 MEN1 (0.35) ALDH1A1POLBNPC1RAB9AMEN1
SCHEMBL22717593 0.77 MEN1 (0.35) ALDH1A1POLBNPC1RAB9AMEN1
SCHEMBL22718354 0.77 MEN1 (0.33) ALDH1A1POLBNPC1RAB9AMEN1
SCHEMBL29573981 0.77 MEN1 (0.33) ALDH1A1POLBNPC1RAB9AMEN1
SCHEMBL22717835 0.76 PTGS1 (0.50) ALDH1A1MGMTMGAMGAASI
SCHEMBL22717376 0.76 NPC1 (0.46) NPC1RAB9AMAPTMGAMGAA
SCHEMBL10821887 0.76 GAA (0.60) ALDH1A1RAB9AMEN1KMT2AMAPT

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
US-20260049074-A1 THIADIAZOLYL DERIVATIVES IDEAYA BIOSCIENCES, INC. (US) 2026-02-19 — — US disclosed
US-12509454-B2 Thiadiazolyl derivatives IDEAYA BIOSCIENCES, INC. (US) 2025-12-30 — — US disclosed
EP-3976608-B1 THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES INC (US) 2023-11-08 — — EP disclosed
EP-3976608-B1 THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES INC (US) 2023-11-08 — — EP disclosed
US-20230078112-A1 THIADIAZOLYL DERIVATIVES IDEAYA BIOSCIENCES, INC. 2023-03-16 — — US disclosed
EP-3976608-A1 THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS Ideaya Biosciences, Inc. (US) 2022-04-06 — — EP disclosed
CN-114127062-A Thiadiazolyl derivatives as inhibitors of DNA polymerase Theta 伊迪亚生物科学有限公司 2022-03-01 — — CN disclosed
WO-2020243459-A1 THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES, INC. (US) 2020-12-03 — — WO disclosed
WO-2020243459-A1 THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES, INC. (US) 2020-12-03 — — 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 (3 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-20260049074-A1 THIADIAZOLYL DERIVATIVES POLH, POLM, POLD1 ALDH1A1 2481/4885POLB 6/4885NPC1 2942/4885
US-20230078112-A1 THIADIAZOLYL DERIVATIVES POLQ, POLK, POLA1 ALDH1A1 1907/4885POLB 6/4885NPC1 3141/4885
US-12509454-B2 Thiadiazolyl derivatives POLD1, POLQ, DNA2 ALDH1A1 1747/4885POLB 7/4885NPC1 3834/4885

“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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