SCHEMBL29209082

SCHEMBL29209082

Cc1cc(Br)cc2c1C(=O)N(C)C2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.42
PARP1 P09874 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
TAS1R2 Q8TE23 1/20 0.35
PIK3CD O00329 1/20 0.32
PIK3R1 P27986 1/20 0.32
PIK3CG P48736 1/20 0.32
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
GABRA1 P14867 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 1/20 0.30
GABRA5 P31644 1/20 0.30
GABRA3 P34903 1/20 0.30
GABRA2 P47869 1/20 0.30
GABRA6 Q16445 1/20 0.30
HTR2A P28223 1/20 0.30

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
SCHEMBL28600318 0.83 MEN1 (0.41) BRD4PARP1MEN1KMT2AMAPT
SCHEMBL24649692 0.81 HTR2A (0.43) BRD4PARP1MEN1KMT2APIK3CG
SCHEMBL4751133 0.81 TAS1R3 (0.34) BRD4TAS1R3TAS1R1TAS1R2PIK3CD
SCHEMBL31543992 0.81 BRD4 (0.41) BRD4PARP1MEN1KMT2APIK3CG
SCHEMBL31239560 0.81 BRD4 (0.41) BRD4PARP1MEN1KMT2A
SCHEMBL29099572 0.81 BRD4 (0.41) BRD4PARP1MEN1KMT2APIK3CG
SCHEMBL29313927 0.79 HTR2A (0.37) PARP1PIK3CDPIK3R1PIK3CGHTR2A
SCHEMBL25463283 0.79 PARP1 (0.41) PARP1KMT2APIK3CDPIK3R1PIK3CG
SCHEMBL31543989 0.78 PIK3CG (0.43) PIK3CDPIK3R1PIK3CG
SCHEMBL8166957 0.78 TAS1R3 (0.33) BRD4TAS1R3TAS1R1TAS1R2PIK3CD

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
US-20240327393-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2024-10-03 US disclosed
CN-117999259-A Iron death modulators, their preparation and use 维泰瑞隆有限公司 2024-05-07 CN disclosed
WO-2023280296-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-01-12 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-20240327393-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF AIFM2, GPX1, GPX4 BRD4 3076/4885PARP1 1706/4885MEN1 3393/4885

“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.