SCHEMBL25354684

SCHEMBL25354684

COCCOCOc1cc(Br)c2c(C)cccc2c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.34
KDM4E B2RXH2 7/20 0.34
LMNA P02545 6/20 0.34
L3MBTL1 Q9Y468 6/20 0.34
TDP1 Q9NUW8 2/20 0.33
F2 P00734 1/20 0.33
ELANE P08246 1/20 0.33
CTNNB1 P35222 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPK1 P28482 3/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
HPGD P15428 2/20 0.32
HTT P42858 1/20 0.32
MAOB P27338 1/20 0.31
CYP1A2 P05177 2/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
GRM5 P41594 1/20 0.31

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
SCHEMBL23409337 0.88 GRM5 (0.36) MAPTKDM4ELMNAL3MBTL1MAPK1
SCHEMBL29903155 0.88 GRM5 (0.36) MAPTKDM4ELMNAL3MBTL1MAPK1
SCHEMBL25354760 0.86 L3MBTL1 (0.34) MAPTKDM4ELMNAL3MBTL1TDP1
SCHEMBL25354201 0.84 CTNNB1 (0.35) KDM4EL3MBTL1TDP1F2ELANE
SCHEMBL30576965 0.84 CTNNB1 (0.35) KDM4EL3MBTL1TDP1F2ELANE
SCHEMBL25428945 0.78 CYP1A2 (0.44) MAPTRAB9ACYP1A2CYP3A4CYP2C9
SCHEMBL29903159 0.76 CYP1A2 (0.35) MAPTKDM4EL3MBTL1NPC1RAB9A
SCHEMBL23409334 0.76 CYP1A2 (0.35) MAPTKDM4EL3MBTL1NPC1RAB9A
SCHEMBL25824423 0.76 HTR2A (0.33) MAPTCYP1A2GRM5
SCHEMBL25353794 0.73 CTNNB1 (0.34) KDM4EL3MBTL1TDP1CTNNB1MAPK1

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
US-20250154170-A1 FUSED PYRIMIDINES AS KRAS INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2025-05-15 US disclosed
EP-4476221-A1 FUSED PYRIMIDINES AS KRAS INHIBITORS Bayer Aktiengesellschaft (DE) 2024-12-18 EP disclosed
WO-2023152255-A1 FUSED PYRIMIDINES AS KRAS INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2023-08-17 WO disclosed
WO-2023152255-A1 FUSED PYRIMIDINES AS KRAS INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2023-08-17 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-20250154170-A1 FUSED PYRIMIDINES AS KRAS INHIBITORS KRAS, NRAS, TP53 MAPT 4220/4885KDM4E 2684/4885LMNA 3478/4885

“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.