SCHEMBL30278983

SCHEMBL30278983

CCCCCCOc1cc(NC2CCC(N)CC2)ccc1C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
S1PR1 P21453 3/20 0.37
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
CNR2 P34972 7/20 0.36
CNR1 P21554 7/20 0.36
PDGFRA P16234 4/20 0.36
CCNE1 P24864 4/20 0.36
CDK2 P24941 4/20 0.36
KIT P10721 1/20 0.35
FLT3 P36888 1/20 0.35
SPHK1 Q9NYA1 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
S1PR4 O95977 1/20 0.34
S1PR3 Q99500 1/20 0.34
S1PR5 Q9H228 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
SCHEMBL25041527 1.00 HTT (0.38) HTTL3MBTL1S1PR1THRATHRB
SCHEMBL25041894 0.91 HTT (0.39) HTTL3MBTL1CNR2KITFLT3
SCHEMBL25039605 0.88 HTT (0.39) HTTL3MBTL1CNR2KITFLT3
SCHEMBL25041778 0.87 BTK (0.37) HTTL3MBTL1CNR2KITFLT3
SCHEMBL31206137 0.87 BTK (0.37) HTTL3MBTL1CNR2KITFLT3
SCHEMBL30279135 0.84 HTT (0.37) HTTL3MBTL1CNR2CDK2KIT
SCHEMBL25041790 0.84 HTT (0.37) HTTL3MBTL1CNR2CDK2KIT
SCHEMBL29218853 0.84 MAPT (0.40) S1PR1THRATHRBCNR2CNR1
SCHEMBL29218880 0.82 CNR2 (0.43) THRATHRBCNR2CNR1
SCHEMBL25041540 0.81 SPHK1 (0.41) S1PR1CNR2CNR1PDGFRACCNE1

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-20240360114-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2024-10-31 US disclosed
EP-4384493-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd (KY) 2024-06-19 EP disclosed
WO-2023016447-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-02-16 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-20240360114-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF AIFM2, GPX1, GPX4 HTT 1377/4885L3MBTL1 1984/4885S1PR1 1493/4885

“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.