SCHEMBL19780901

SCHEMBL19780901

COC(=O)CNCC(S)NP

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.37
HSD17B10 Q99714 1/20 0.37
TET2 Q6N021 1/20 0.35
RECQL P46063 1/20 0.34
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32

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
SCHEMBL19781308 0.84 TSHR (0.39) TSHRHSD17B10TET2RECQLMGAM
SCHEMBL21212793 0.78 TET2 (0.36) TSHRHSD17B10TET2RECQLMGAM
SCHEMBL20362833 0.78 TSHR (0.41) TSHRHSD17B10TET2RECQLMGAM
SCHEMBL3604649 0.73 CA12 (0.44) TSHRHSD17B10TET2RECQLMGAM
Hydrochloric Acid SCHEMBL18577216 0.71 CA12 (0.43) TSHRHSD17B10TET2RECQLMGAM
SCHEMBL21946049 0.71 TSHR (0.40) TSHRHSD17B10TET2RECQLMGAM
SCHEMBL16894217 0.71 TSHR (0.40) TSHRHSD17B10TET2RECQLMGAM
SCHEMBL73416 0.71 TSHR (0.56) TSHRHSD17B10TET2RECQLMGAM
SCHEMBL11237051 0.69 TET2 (0.39) TSHRHSD17B10TET2RECQLMGAM
SCHEMBL21708634 0.69 TET2 (0.39) TSHRHSD17B10TET2RECQLMGAM

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
EP-3485014-B1 PNA PROBE DESTINA GENOMICA S L (ES) 2023-09-06 EP disclosed
WO-2018011320-A1 PNA PROBE Destina Genomica S.L. (ES) 2018-01-18 WO disclosed