SCHEMBL25982014

SCHEMBL25982014

COc1ccc(CN(C)c2cc(C)c(C(F)(F)F)c(Br)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
ADORA2A P29274 1/20 0.38
ERAP1 Q9NZ08 1/20 0.36
MAPT P10636 4/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
KDM4E B2RXH2 1/20 0.35
FABP4 P15090 3/20 0.35
TP53 P04637 1/20 0.35
PYCR1 P32322 1/20 0.35
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
GAA P10253 1/20 0.34
PTGS2 P35354 1/20 0.34
PDE2A O00408 1/20 0.34
TSHR P16473 2/20 0.34
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CHRM2 P08172 1/20 0.34
CYP3A4 P08684 1/20 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
SCHEMBL21733449 0.89 LMNA (0.37) ALDH1A1MAPTL3MBTL1KDM4EFABP4
SCHEMBL29384926 0.89 LMNA (0.37) ALDH1A1MAPTL3MBTL1KDM4EFABP4
SCHEMBL25339260 0.85 LMNA (0.34) ALDH1A1MAPTL3MBTL1KDM4EFABP4
SCHEMBL25982013 0.79 ALDH1A1 (0.42) ALDH1A1ADORA2AMAPTL3MBTL1KDM4E
SCHEMBL25982121 0.78 ALDH1A1 (0.46) ALDH1A1ADORA2AMAPTPYCR1KMT2A
SCHEMBL31234941 0.76 PIK3CD (0.39) ALDH1A1MAPTKDM4EFABP4TP53
SCHEMBL21734048 0.75 PIK3CD (0.42) ALDH1A1MAPTL3MBTL1KDM4EFABP4
SCHEMBL31196081 0.75 PIK3CA (0.37) ALDH1A1MAPTL3MBTL1KDM4EFABP4
SCHEMBL21722225 0.75 ALDH1A1 (0.45) ALDH1A1ADORA2AMAPTL3MBTL1PYCR1
SCHEMBL25065874 0.74 MAPT (0.45) ALDH1A1ADORA2AMAPTL3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4547666-A1 METHODS FOR TREATMENT OF CANCER Frontier Medicines Corporation (US) 2025-05-07 EP disclosed
WO-2024006445-A1 METHODS FOR TREATMENT OF CANCER FRONTIER MEDICINES CORPORATION (US) 2024-01-04 WO disclosed
US-20230250074-A1 PROCESS FOR SYNTHESIS OF QUINAZOLINE COMPOUNDS GENENTECH, INC. (US) 2023-08-10 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-20230250074-A1 PROCESS FOR SYNTHESIS OF QUINAZOLINE COMPOUNDS HCCS, NQO2, SQLE ALDH1A1 3225/4885ADORA2A 3164/4885ERAP1 3579/4885

“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.