SCHEMBL7432173

SCHEMBL7432173

CN(O)C(=O)C1(N)CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 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
SCHEMBL11794573 0.98 TSHR (0.30) TSHRCYP2C19
SCHEMBL19406478 0.84 MEN1 (0.37) TSHRCYP2C19MEN1POLBKMT2A
SCHEMBL5522534 0.81 MEN1 (0.34) TSHRCYP2C19MEN1POLBKMT2A
SCHEMBL21267725 0.77
Trifluoroacetic Acid SCHEMBL2496570 0.72 CPB2 (0.34) MEN1POLBKMT2A
SCHEMBL27274994 0.71 LMNA (0.33) LMNA
SCHEMBL12402118 0.70 TSHR (0.39) TSHRCYP2C19LMNA
SCHEMBL5032422 0.70
SCHEMBL6473327 0.70 HSD11B1 (0.32)
Trifluoroacetic Acid SCHEMBL2496292 0.70 TACR1 (0.32)

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-1147078-A1 ACETYLENIC (BETA)-SULFONAMIDO AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS American Cyanamid Company (US) 2001-10-24 EP disclosed
WO-2000044711-A1 ACETYLENIC $G(b)-SULFONAMIDO AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 WO disclosed