SCHEMBL9930540

SCHEMBL9930540

Oc1ncnc2cscc12

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HTT P42858 2/20 0.38
NCOA1 Q15788 2/20 0.38
NCOA3 Q9Y6Q9 2/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
PPARG P37231 1/20 0.38
NCOA2 Q15596 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
IRAK4 Q9NWZ3 1/20 0.38

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
SCHEMBL9432581 0.67
Quinazolinone SCHEMBL164234 0.67 PI4KA (0.56) ALDH1A1HTTMAPTTDP1
SCHEMBL2538320 0.67 KDM4E (0.33) KDM4EALDH1A1HTTNCOA1NCOA3
SCHEMBL18013039 0.67 EGFR (0.42) IRAK4
SCHEMBL11814148 0.66 SMN1; SMN2 (0.53) KDM4EALDH1A1HTTMAPTHPGD
SCHEMBL1192531 0.64 PARP1 (0.47) KDM4EALDH1A1HTTMAPTHPGD
SCHEMBL8813539 0.64 MAPK13 (0.34) HPGD
SCHEMBL1011251 0.64 IRAK4 (0.39) IRAK4
SCHEMBL8807100 0.64 EGFR (0.41) KDM4EALDH1A1HTTMAPTIRAK4
SCHEMBL5453911 0.64 EGFR (0.46) KDM4EALDH1A1HTTMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4591866-A1 USE OF HYPOXIA-ACTIVATED COMPOUND IN PREPARATION OF MEDICAMENT FOR TREATING CANCER PATIENT Ascentawits Pharmaceuticals, Ltd. (CN) 2025-07-30 EP disclosed
CN-119894521-A Use of hypoxia-activated compounds for the preparation of a medicament for the treatment of cancer patients 深圳艾欣达伟医药科技有限公司 2025-04-25 CN disclosed
WO-2024061346-A1 USE OF HYPOXIA-ACTIVATED COMPOUND IN PREPARATION OF MEDICAMENT FOR TREATING CANCER PATIENT 深圳艾欣达伟医药科技有限公司 2024-03-28 WO disclosed
US-20120157439-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2012-06-21 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-20120157439-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF KDM4E 3645/4885ALDH1A1 1048/4885HTT 4587/4885

“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.