SCHEMBL9314823

SCHEMBL9314823

CCOC(C)C(S)C(=O)ON1C(=O)CCC1=O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
LMNA P02545 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL8721919 1.00 ALDH1A1 (0.33) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL327485 0.82 ALDH1A1 (0.35) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL18540883 0.78 MGLL (0.34) KMT2A
SCHEMBL8004731 0.76 TSHR (0.33) ALDH1A1
SCHEMBL9314819 0.76 TSHR (0.33) ALDH1A1
SCHEMBL10075274 0.76 SMN1; SMN2 (0.35) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL16133577 0.75 MGLL (0.35) ALDH1A1MEN1KMT2ALMNARAB9A
SCHEMBL261924 0.75 MGLL (0.35) ALDH1A1MEN1KMT2ALMNARAB9A
SCHEMBL7006081 0.74 ACE (0.34) KMT2A
SCHEMBL277464 0.74 ALDH1A1 (0.33) ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0461245-A4 RADIOLABELED PROTEINS FOR DIAGNOSTIC OR THERAPEUTIC USE GUSTAVSON LINDA M (US) 1994-10-05 EP disclosed
EP-0461245-A1 RADIOLABELED PROTEINS FOR DIAGNOSTIC OR THERAPEUTIC USE NEORX CORPORATION (US) 1991-12-18 EP disclosed
WO-1991009876-A1 RADIOLABELED PROTEINS FOR DIAGNOSTIC OR THERAPEUTIC USE NEORX CORPORATION (US) 1991-07-11 WO disclosed