SCHEMBL7590803

SCHEMBL7590803

Cc1ccc(S(=O)(=O)NC(=O)OCCc2ccc(-n3c(CCCN4CCCC4=O)nc4cc(C(F)(F)F)c(Cl)cc43)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.37
PDK2 Q15119 1/20 0.37
PDK3 Q15120 1/20 0.37
PDK4 Q16654 1/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
LMNA P02545 3/20 0.36
PTGER4 P35408 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
PAX8 Q06710 1/20 0.35
CYP2C19 P33261 1/20 0.35
HDAC1 Q13547 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
TSHR P16473 1/20 0.33

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
SCHEMBL2356746 0.86 PTGER4 (0.48) PTGER4MAPTKMT2A
SCHEMBL1626739 0.84 L3MBTL1 (0.36) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL1624469 0.83 L3MBTL1 (0.35) PDK1PDK2PDK3PDK4SMN1; SMN2
SCHEMBL6713139 0.80 PTGER4 (0.40) PTGER4
SCHEMBL21470221 0.79 PTGER4 (0.37) SMN1; SMN2LMNAPTGER4ALDH1A1MAPT
SCHEMBL30114904 0.79 PTGER4 (0.37) SMN1; SMN2LMNAPTGER4ALDH1A1MAPT
SCHEMBL3949397 0.79 KCNH2 (0.36) PDK1PDK2PDK3PDK4SMN1; SMN2
SCHEMBL21470115 0.78 AGTR2 (0.37) PTGER4KDM4EMEN1MAPTKMT2A
SCHEMBL30114922 0.78 AGTR2 (0.37) PTGER4KDM4EMEN1MAPTKMT2A
SCHEMBL21470223 0.78 PTGER4 (0.37) PTGER4KDM4EMEN1MAPTKMT2A

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-20020107273-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents ASKAT INC. (JP) 2002-08-08 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-20020107273-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents PTGS1, PTGS2, OPRM1 PDK1 3272/4885PDK2 4360/4885PDK3 3754/4885

“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.