SCHEMBL30336331

SCHEMBL30336331

CC(C)(C)c1ccc(Nc2ccc3c(c2)OCC(=O)N3)cc1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.65
KIF11 P52732 3/20 0.65
PKM P14618 3/20 0.46
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
MMP12 P39900 1/20 0.43
TNIK Q9UKE5 1/20 0.43
POLB P06746 1/20 0.42
IDH1 O75874 1/20 0.42
P2RX3 P56373 1/20 0.42
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41

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
SCHEMBL24864966 1.00 TRPV1 (0.65) TRPV1KIF11PKMGABRG2GABRB3
SCHEMBL762348 0.84 TRPV1 (0.58) TRPV1KIF11PKMMMP12POLB
SCHEMBL6297431 0.82 KIF11 (0.62) TRPV1KIF11PKMGABRG2GABRB3
SCHEMBL6297491 0.82 KIF11 (0.58) TRPV1KIF11PKMPOLB
SCHEMBL10269414 0.81 KIF11 (0.60) TRPV1KIF11PKMGABRG2GABRB3
SCHEMBL13675531 0.80 TRPV1 (1.00) TRPV1POLB
SCHEMBL13676060 0.79 TRPV1 (0.66) TRPV1KIF11POLB
SCHEMBL12362001 0.79 KIF11 (0.56) TRPV1KIF11PKMGABRG2GABRB3
SCHEMBL16208445 0.79 KIF11 (1.00) TRPV1KIF11PKMPOLB
SCHEMBL23432581 0.76 KIF11 (0.54) TRPV1KIF11PKMGABRG2GABRB3

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 TRPV1 3135/4885KIF11 4664/4885PKM 327/4885

“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.