SCHEMBL3108445

SCHEMBL3108445

Cn1c(-c2cc[nH]c(=O)c2)n[nH]c1=S

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.55
LMNA P02545 1/20 0.55
APOBEC3G Q9HC16 6/20 0.55
ALDH1A1 P00352 6/20 0.55
KDM4E B2RXH2 8/20 0.50
HPGD P15428 4/20 0.50
TDP1 Q9NUW8 2/20 0.50
TSHR P16473 2/20 0.50
MAPT P10636 1/20 0.50
GFER P55789 1/20 0.50
POLB P06746 1/20 0.50
ALOX15 P16050 1/20 0.50
PKM P14618 1/20 0.45
GAA P10253 2/20 0.43
NOTUM Q6P988 1/20 0.41
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL3105626 0.77 HSD17B10 (0.53) HSD17B10LMNAAPOBEC3GALDH1A1KDM4E
SCHEMBL2311265 0.72 ALDH1A1 (0.66) HSD17B10LMNAAPOBEC3GALDH1A1KDM4E
SCHEMBL919250 0.72 HSD17B10 (0.73) HSD17B10LMNAAPOBEC3GALDH1A1KDM4E
SCHEMBL8762409 0.71 APOBEC3G (0.63) HSD17B10LMNAAPOBEC3GALDH1A1KDM4E
SCHEMBL17725193 0.71 MAPK13 (0.42) MAPTNOTUMPDE3BPDE3A
SCHEMBL9222389 0.71 HSD17B10 (0.61) HSD17B10LMNAAPOBEC3GALDH1A1KDM4E
SCHEMBL1544475 0.70 HSD17B10 (0.71) HSD17B10LMNAAPOBEC3GALDH1A1KDM4E
SCHEMBL8978546 0.70 KDM4E (0.68) HSD17B10LMNAAPOBEC3GALDH1A1KDM4E
SCHEMBL1544445 0.69 HSD17B10 (0.74) HSD17B10LMNAAPOBEC3GALDH1A1KDM4E
SCHEMBL2893202 0.69 HSD17B10 (0.59) HSD17B10LMNAAPOBEC3GALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010123451-A1 SULPHIDE BRIDGED DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2010-10-28 WO claimed
US-20100273805-A1 SULPHIDE BRIDGED DERIVATIVES AS MODULATORS OF MGLUR5 733 ASTRAZENECA AB (SE) 2010-10-28 US claimed
US-20100273805-A1 SULPHIDE BRIDGED DERIVATIVES AS MODULATORS OF MGLUR5 733 ASTRAZENECA AB (SE) 2010-10-28 US disclosed
US-20100273805-A1 SULPHIDE BRIDGED DERIVATIVES AS MODULATORS OF MGLUR5 733 ASTRAZENECA AB (SE) 2010-10-28 US disclosed
US-20100273805-A1 SULPHIDE BRIDGED DERIVATIVES AS MODULATORS OF MGLUR5 733 ASTRAZENECA AB (SE) 2010-10-28 US disclosed
WO-2010123451-A1 SULPHIDE BRIDGED DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2010-10-28 WO disclosed
WO-2010123451-A1 SULPHIDE BRIDGED DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2010-10-28 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-20100273805-A1 SULPHIDE BRIDGED DERIVATIVES AS MODULATORS OF MGLUR5 733 GRM5, GRM3, GRIK5 HSD17B10 3478/4885LMNA 4804/4885APOBEC3G 4622/4885

“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.