SCHEMBL19175124

SCHEMBL19175124

CCc1ccccc1OCCS(=O)(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 7/20 0.59
MAPT P10636 2/20 0.59
NPSR1 Q6W5P4 1/20 0.59
HPGD P15428 1/20 0.51
ATM Q13315 1/20 0.51
KDM4E B2RXH2 4/20 0.48
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
TSHR P16473 2/20 0.41
HSD17B10 Q99714 1/20 0.41
NISCH Q9Y2I1 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
PPARD Q03181 1/20 0.39
POLB P06746 1/20 0.39
LMNA P02545 1/20 0.39
DRD2 P14416 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
SCHEMBL25476561 0.85 L3MBTL1 (0.41) L3MBTL1MAPTNPSR1HPGDATM
SCHEMBL10783529 0.81 L3MBTL1 (0.84) L3MBTL1MAPTNPSR1HPGDATM
SCHEMBL14606832 0.80 HTR7 (0.42) MAPTHPGDKDM4EMEN1KMT2A
SCHEMBL17445913 0.79 L3MBTL1 (0.74) L3MBTL1MAPTNPSR1HPGDATM
SCHEMBL10595519 0.79 L3MBTL1 (0.74) L3MBTL1MAPTNPSR1HPGDATM
SCHEMBL5147221 0.78 L3MBTL1 (0.67) L3MBTL1MAPTNPSR1HPGDATM
SCHEMBL9498082 0.78 L3MBTL1 (0.53) L3MBTL1MAPTNPSR1HPGDATM
SCHEMBL5420692 0.77 L3MBTL1 (0.71) L3MBTL1MAPTNPSR1HPGDATM
SCHEMBL2127883 0.77 THRA (0.51) MAPTMEN1KMT2ACYP3A4PPARD
SCHEMBL19846321 0.77 HTR1A (0.41) L3MBTL1MAPTNPSR1HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9932309-B2 2-oxo-3,4-dihydropyridine-5-carboxylates and their use UNIVERSITE DE LILLE 2 DROIT ET SANTE (FR) 2018-04-03 US disclosed
US-20170210710-A1 2-OXO-3,4-DIHYDROPYRIDINE-5-CARBOXYLATES AND THEIR USE INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2017-07-27 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-20170210710-A1 2-OXO-3,4-DIHYDROPYRIDINE-5-CARBOXYLATES AND THEIR USE CYP3A5, CYP2D6, QDPR L3MBTL1 4818/4885MAPT 1502/4885NPSR1 1015/4885

“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.