SCHEMBL4263485

SCHEMBL4263485

CCSC(=O)N(CC)CC.[LiH]

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.62
MAPK1 P28482 1/20 0.62
ALDH1A1 P00352 5/20 0.42
LMNA P02545 2/20 0.39
PHGDH O43175 3/20 0.37
MGLL Q99685 3/20 0.37
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP3 P08254 1/20 0.37
MMP8 P22894 1/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
HSD17B10 Q99714 3/20 0.35
ALDH2 P05091 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
HPGD P15428 2/20 0.35
HTR1A P08908 2/20 0.35
PLIN1 O60240 1/20 0.35
GMNN O75496 1/20 0.35
TRPA1 O75762 1/20 0.35

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
SCHEMBL134304 0.97 TSHR (0.65) TSHRMAPK1ALDH1A1LMNAPHGDH
Methane SCHEMBL2159555 0.92 TSHR (0.60) TSHRMAPK1ALDH1A1LMNAPHGDH
SCHEMBL24470878 0.81 TSHR (0.46) TSHRMAPK1ALDH1A1LMNAPHGDH
SCHEMBL21221413 0.81 PHGDH (0.50) TSHRMAPK1ALDH1A1LMNAPHGDH
SCHEMBL8104956 0.80 TSHR (0.63) TSHRMAPK1ALDH1A1LMNAMGLL
S-Ethyl Dipropylcarbamothioate SCHEMBL8541416 0.77 TSHR (1.00) TSHRMAPK1ALDH1A1KMT2AMEN1
SCHEMBL9420118 0.77 ALDH1A1 (0.49) TSHRMAPK1ALDH1A1LMNAPHGDH
S-Ethyl Dipropylcarbamothioate SCHEMBL66482 0.77 TSHR (1.00) TSHRMAPK1ALDH1A1KMT2AMEN1
Butylate SCHEMBL5077084 0.77 TSHR (0.54) TSHRMAPK1ALDH1A1HSD17B10CA12
SCHEMBL11454569 0.77 TSHR (0.59) TSHRMAPK1ALDH1A1MGLLMMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7626008-B2 Anti-angiogenic polypeptides WAISMAN DAVID M 2009-12-01 US disclosed
CN-100491394-C Anti-angiogenic polypeptides DAVID M WAISMAN KASSAM GEETHA (CA) 2009-05-27 CN disclosed
US-20090061510-A1 Vectors, eukaryotic cells WAISMAN DAVID M 2009-03-05 US disclosed
US-7420036-B2 Anti-angiogenic polypeptides WAISMAN DAVID M 2008-09-02 US disclosed
EP-1337548-B1 ANTI-ANGIOGENIC POLYPEPTIDES WAISMAN DAVID M (CA) 2008-07-16 EP disclosed
EP-1337548-A4 ANTI-ANGIOGENIC POLYPEPTIDES WAISMAN DAVID M (CA) 2005-01-12 EP disclosed
CN-1498223-A Anti-angiogenic polypeptides M 2004-05-19 CN disclosed
US-20040082030-A1 Anti-angiogenic polypeptides WAISMAN DAVID M (CA) 2004-04-29 US disclosed
EP-1337548-A2 ANTI-ANGIOGENIC POLYPEPTIDES Waisman, David M. (CA) 2003-08-27 EP disclosed
WO-2002044328-A2 ANTI-ANGIOGENIC POLYPEPTIDES WAISMAN DAVID M (CA) 2002-06-06 WO disclosed