SCHEMBL11235406

SCHEMBL11235406

CCOC(=O)C=C(C)NC(=S)Cc1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.41
ALDH1A1 P00352 3/20 0.40
NPC1 O15118 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
CRHBP P24387 2/20 0.40
CRHR2 Q13324 2/20 0.40
POLB P06746 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
RAB9A P51151 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL11221194 0.87 MAPT (0.44) MAPTL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL11221192 0.87 MAPT (0.44) MAPTL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL11226263 0.86 SMN1; SMN2 (0.48) MAPTL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL11226156 0.84 TSHR (0.36) MAPTL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL11228783 0.81 PHGDH (0.37) MAPTALDH1A1SMN1; SMN2TSHR
SCHEMBL11228781 0.81 PHGDH (0.37) MAPTALDH1A1SMN1; SMN2TSHR
SCHEMBL11235694 0.81 NPC1 (0.49) MAPTL3MBTL1ALDH1A1NPC1MEN1
SCHEMBL11235712 0.81 NPC1 (0.49) MAPTL3MBTL1ALDH1A1NPC1MEN1
SCHEMBL11726774 0.79 MEN1 (0.50) MAPTL3MBTL1ALDH1A1NPC1MEN1
SCHEMBL11726763 0.79 MEN1 (0.50) MAPTL3MBTL1ALDH1A1NPC1MEN1

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-4358606-A Esters of phenalkyloxycarbonylamino acids ZOECON CORPORATION (US) 1982-11-09 US disclosed