SCHEMBL25814975

SCHEMBL25814975

O=c1[nH]c(=O)c2cc(F)c(Br)c(F)c2[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.39
CSNK2A2 P19784 1/20 0.39
CSNK2B P67870 1/20 0.39
CSNK2A1 P68400 1/20 0.39
TYMP P19971 5/20 0.34
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
PNP P00491 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
CYP19A1 P11511 1/20 0.34
TSHR P16473 1/20 0.34
THPO P40225 1/20 0.34
MTOR P42345 1/20 0.34
HTT P42858 1/20 0.34
HBB P68871 1/20 0.34
PMP22 Q01453 1/20 0.34
GRIN2D O15399 4/20 0.34
GRIN3B O60391 4/20 0.34
GRIN1 Q05586 4/20 0.34

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
SCHEMBL7032887 0.83 GRIN2D (0.38) TYMPALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL29592452 0.83 IDH1 (0.36) IDH1CSNK2A2CSNK2BCSNK2A1TYMP
SCHEMBL21379214 0.83 IDH1 (0.36) IDH1CSNK2A2CSNK2BCSNK2A1TYMP
SCHEMBL16637455 0.83 IDH1 (0.36) IDH1CSNK2A2CSNK2BCSNK2A1TYMP
SCHEMBL29388927 0.83 IDH1 (0.36) IDH1CSNK2A2CSNK2BCSNK2A1TYMP
SCHEMBL24004705 0.80 GRIN2D (0.38) IDH1CSNK2A2CSNK2BCSNK2A1TYMP
SCHEMBL31542506 0.80 IDH1 (0.34) IDH1CSNK2A2CSNK2BCSNK2A1TYMP
SCHEMBL25820506 0.79 DPYD (0.38) IDH1CSNK2A2CSNK2BCSNK2A1TYMP
SCHEMBL31748457 0.78 GRIN2D (0.44) IDH1CSNK2A2CSNK2BCSNK2A1ALDH1A1
SCHEMBL25330088 0.78 SIRT2 (0.41) TYMPALDH1A1LMNAMAPTTSHR

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-20250276982-A1 KRAS INHIBITORS ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) 2025-09-04 US disclosed
US-20240246954-A1 COMPOSITIONS AND METHODS FOR INHIBITING KRAS THERAS, INC. 2024-07-25 US disclosed
CN-117794930-A KRAS inhibitors 苏州亚盛药业有限公司 2024-03-29 CN disclosed
WO-2024061365-A1 PYRIMIDINE FUSED RING COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF 成都奥睿药业有限公司 2024-03-28 WO disclosed
EP-4294799-A2 COMPOSITIONS AND METHODS FOR INHIBITION OF RAS Theras Inc. (US) 2023-12-27 EP disclosed
CN-117157290-A Compositions and methods for inhibiting KRAS 瑟拉斯有限公司 2023-12-01 CN disclosed
WO-2023125989-A1 QUINAZOLINE COMPOUND AND APPLICATION THEREOF 上海医药集团股份有限公司 2023-07-06 WO disclosed
WO-2023030495-A1 KRAS INHIBITORS ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) 2023-03-09 WO disclosed
WO-2022177917-A2 COMPOSITIONS AND METHODS FOR INHIBITION OF RAS THERAS, INC. (US) 2022-08-25 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 (2 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-20240246954-A1 COMPOSITIONS AND METHODS FOR INHIBITING KRAS KRAS, NRAS, HRAS IDH1 71/4885CSNK2A2 769/4885CSNK2B 638/4885
US-20250276982-A1 KRAS INHIBITORS KRAS, NRAS, HRAS IDH1 235/4885CSNK2A2 2239/4885CSNK2B 1654/4885

“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.