SCHEMBL24050980

SCHEMBL24050980

O=C1NCC(Cc2ccc(OCC(=O)c3ccccc3Cl)cc2)S1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.47
CYP2C9 P11712 3/20 0.40
MPC2 O95563 2/20 0.40
CYP2C8 P10632 2/20 0.40
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
FFAR1 O14842 4/20 0.35
CYP2C19 P33261 1/20 0.34
HTR2B P41595 1/20 0.34
MAPK14 Q16539 1/20 0.34
RAB9A P51151 2/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NPC1 O15118 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
SCHEMBL24051118 0.81 PPARG (0.52) PPARGCYP2C9MPC2CYP2C8SMN1; SMN2
SCHEMBL936483 0.81 PPARG (0.72) PPARGCYP2C9MPC2CYP2C8FFAR1
SCHEMBL25832955 0.79 PPARG (0.49) PPARGCYP2C9MPC2CYP2C8FFAR1
SCHEMBL8282070 0.77 PPARG (0.47) PPARGCYP2C9MPC2CYP2C8LMNA
SCHEMBL21504819 0.75 PPARG (0.50) PPARGCYP2C9MPC2CYP2C8SMN1; SMN2
SCHEMBL19217857 0.74 PPARG (0.49) PPARGCYP2C9MPC2CYP2C8LMNA
SCHEMBL29207071 0.72 RAB9A (0.56) LMNASMN1; SMN2RAB9AMAPTNPSR1
SCHEMBL18541489 0.68 PPARG (0.73) PPARGCYP2C9MPC2CYP2C8FFAR1
SCHEMBL12628141 0.68 PPARG (0.73) PPARGCYP2C9MPC2CYP2C8FFAR1
SCHEMBL936978 0.68 PPARG (0.73) PPARGCYP2C9MPC2CYP2C8FFAR1

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-20210361629-A1 THIAZOLIDINEDIONE ANALOGS FOR THE TREATMENT OF NAFLD AND METABOLIC DISEASES CIRIUS THERAPEUTICS, INC. 2021-11-25 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-20210361629-A1 THIAZOLIDINEDIONE ANALOGS FOR THE TREATMENT OF NAFLD AND METABOLIC DISEASES PPARD, FABP1, GOT2 PPARG 4/4885CYP2C9 1337/4885MPC2 194/4885

“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.