SCHEMBL11281069

SCHEMBL11281069

O=C(c1cc(=O)n(-c2ccccc2)[nH]1)N(CCO)CCO

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 13/20 0.48
TSHR P16473 1/20 0.46
CTSA P10619 4/20 0.46
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
BLM P54132 1/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL8942505 0.81 ALKBH5 (0.55) ALKBH5TSHRCTSAALDH1A1LMNA
SCHEMBL11797522 0.78 ALKBH5 (0.52) ALKBH5TSHRCTSAALDH1A1LMNA
SCHEMBL951472 0.78 ALKBH5 (0.73) ALKBH5TSHRCTSAALDH1A1LMNA
SCHEMBL11334785 0.77 ALKBH5 (0.61) ALKBH5TSHRCTSAALDH1A1LMNA
SCHEMBL8942367 0.76 CTSA (0.53) ALKBH5TSHRCTSAALDH1A1LMNA
SCHEMBL11441556 0.75 ALKBH5 (0.59) ALKBH5TSHRCTSAALDH1A1LMNA
SCHEMBL10976136 0.75 ALKBH5 (0.55) ALKBH5TSHRCTSAALDH1A1LMNA
SCHEMBL6143137 0.75 ALKBH5 (0.55) ALKBH5TSHRCTSAALDH1A1LMNA
SCHEMBL11043171 0.74 ALKBH5 (0.55) ALKBH5TSHRCTSAALDH1A1LMNA
SCHEMBL1819463 0.73 ALKBH5 (0.61) ALKBH5TSHRCTSAALDH1A1LMNA

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-4348528-A Process for the preparation of 1-phenyl-3-carbamoyl-5-pyrazolones P C U K PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1982-09-07 US disclosed