SCHEMBL24616751

SCHEMBL24616751

CCOC(=O)c1nc2ccc(I)cn2c1Cl

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.48
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
GABRA2 P47869 3/20 0.45
GABRB2 P47870 3/20 0.45
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
GAA P10253 1/20 0.44
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
KDM4E B2RXH2 1/20 0.41
MAPK1 P28482 1/20 0.41
TARBP2 Q15633 1/20 0.40
SLC2A1 P11166 1/20 0.39
SLC2A2 P11168 1/20 0.39

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
SCHEMBL17810189 0.86 PDE4A (0.50) PDE4ACYP1A2CYP2C9CYP2C19GABRA2
SCHEMBL22519155 0.86 CYP1A2 (0.59) CYP1A2CYP2C9CYP2C19GABRA2GABRB2
SCHEMBL9923912 0.86 RAB9A (0.55) PDE4ACYP1A2CYP2C9CYP2C19GABRA2
SCHEMBL3499390 0.82 SLC2A2 (0.58) CYP1A2CYP2C9CYP2C19GABRA2GABRB2
SCHEMBL9925354 0.81 MAPT (0.45) PDE4ACYP1A2CYP2C9CYP2C19GABRA2
SCHEMBL24616739 0.81 PDE4A (0.47) PDE4AGABRA2GABRB2PTGS1PTGS2
SCHEMBL23387882 0.78 PTGS1 (0.65) PDE4ACYP1A2CYP2C9CYP2C19PTGS1
SCHEMBL29937800 0.77 PTGS1 (0.42) PDE4ACYP1A2CYP2C9CYP2C19GABRA2
SCHEMBL25296836 0.76 CYP1A2 (0.39) PDE4ACYP1A2CYP2C9CYP2C19GABRA2
SCHEMBL22519135 0.75 NPC1 (0.56) PDE4APTGS1PTGS2GAANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220217979-A1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD PEST CONTROL COMPOSITION CONTAINING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2022-07-14 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-20220217979-A1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD PEST CONTROL COMPOSITION CONTAINING SAME C5, COX6C, C1S PDE4A 1266/4885CYP1A2 57/4885CYP2C9 163/4885

“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.