SCHEMBL29574339

SCHEMBL29574339

C[C@@H]1CN(c2ncccc2C(=O)O)CCO1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.62
MYC P01106 1/20 0.48
RBP4 P02753 2/20 0.46
TTR P02766 1/20 0.46
OPRK1 P41145 2/20 0.43
GSK3A P49840 1/20 0.42
SCN10A Q9Y5Y9 1/20 0.42
FFAR2 O15552 5/20 0.41
CDC7 O00311 1/20 0.41
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
CHIA Q9BZP6 1/20 0.40

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
SCHEMBL22717519 1.00 KMT2A (0.62) KMT2AMYCRBP4TTROPRK1
SCHEMBL28229508 0.81 KMT2A (0.52) KMT2AMYCRBP4TTROPRK1
SCHEMBL30417107 0.80 FFAR2 (0.45) FFAR2CDC7
SCHEMBL29574622 0.79 KMT2A (0.65) KMT2AMYCMEN1CYP1A2CYP3A4
SCHEMBL353809 0.79 KMT2A (0.65) KMT2AMYCMEN1CYP1A2CYP3A4
SCHEMBL31718061 0.79 CHI3L1 (0.49) FFAR2CDC7CHIA
SCHEMBL10926941 0.77 KMT2A (0.70) KMT2AMYCRBP4TTRMEN1
SCHEMBL24297726 0.76 KMT2A (0.68) KMT2AMYCRBP4TTROPRK1
SCHEMBL16034182 0.76 KMT2A (0.68) KMT2AMYCRBP4TTROPRK1
SCHEMBL22717655 0.75 KMT2A (0.59) KMT2AMYCMEN1CYP1A2CYP3A4

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 5 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
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

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 KMT2A 2910/4885MYC 1533/4885RBP4 4449/4885
US-20230078112-A1 THIADIAZOLYL DERIVATIVES POLQ, POLK, POLA1 KMT2A 2938/4885MYC 2800/4885RBP4 3974/4885
US-12509454-B2 Thiadiazolyl derivatives POLD1, POLQ, DNA2 KMT2A 2518/4885MYC 3495/4885RBP4 4691/4885

“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.