SCHEMBL11364508

SCHEMBL11364508

CC(=O)NC(=O)N(S)c1c(Cl)cccc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.36
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
TYK2 P29597 1/20 0.35
ALDH1A1 P00352 4/20 0.34
KMT2A Q03164 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
EPHX1 P07099 2/20 0.33
LMNA P02545 2/20 0.33
POLB P06746 2/20 0.33
MEN1 O00255 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 2/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
NOTUM Q6P988 1/20 0.33
PKM P14618 1/20 0.32

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
SCHEMBL11540445 0.82 KMT2A (0.42) TYK2ALDH1A1KMT2APOLBMEN1
SCHEMBL11367097 0.82 ALDH1A1 (0.42) ATMJAK2JAK1TYK2ALDH1A1
SCHEMBL11079112 0.79 MEN1 (0.46) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL11849641 0.73 HPGD (0.41) ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL11542709 0.73 KMT2A (0.39) TYK2KMT2AMAPT
SCHEMBL11363392 0.72 EPHX1 (0.47) ALDH1A1KMT2AEPHX1POLBMEN1
SCHEMBL3264512 0.72 ALDH1A1 (0.40) ATMALDH1A1KMT2ACYP1A2CYP3A4
SCHEMBL11881288 0.70 GAA (0.37) ATMJAK2JAK1TYK2ALDH1A1
SCHEMBL30132112 0.66 FSCN1 (0.48) ALDH1A1KMT2ALMNAPOLBMEN1
SCHEMBL10441682 0.64 ALDH1A1 (0.40) ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19

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-4290971-A HYPOTENSIVE AGENTS DSO "PHARMACHIM" (BG) 1981-09-22 US disclosed