SCHEMBL11247962

SCHEMBL11247962

CSC(=N)NC(=O)C(Br)c1c(Cl)cccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLS O94925 3/20 0.40
MAPT P10636 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TAS1R3 Q7RTX0 3/20 0.33
TAS1R1 Q7RTX1 3/20 0.33
TAS1R2 Q8TE23 3/20 0.33
S1PR2 O95136 1/20 0.32
S1PR4 O95977 1/20 0.32
S1PR3 Q99500 1/20 0.32
F2 P00734 1/20 0.32
F10 P00742 1/20 0.32
PLAU P00749 1/20 0.32
PLAT P00750 1/20 0.32
HTT P42858 1/20 0.32
HDAC4 P56524 2/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL11249698 0.80 CYP1A2 (0.38) GLSMAPTMEN1KMT2AALDH1A1
SCHEMBL11244852 0.72 POLB (0.34) MEN1KMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL11263022 0.72 POLB (0.34) MEN1KMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL5179498 0.70 ALDH1A1 (0.40) MAPTKMT2AALDH1A1TAS1R3TAS1R1
SCHEMBL9125705 0.69 KMT2A (0.40) MEN1KMT2AALDH1A1HPGD
SCHEMBL11247894 0.68 TSHR (0.42) MEN1KMT2AALDH1A1
SCHEMBL11241971 0.68 ALDH1A1 (0.41) MEN1KMT2AALDH1A1SMN1; SMN2POLB
SCHEMBL11247965 0.68 NPC1 (0.38) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL9274763 0.66 PDK1 (0.39) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL11373826 0.65 NLRP3 (0.41) MAPTMEN1KMT2AALDH1A1POLB

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-4318915-A Substituted guandines and methods of preparation thereof BEIERSDORF AKTIENGESELLSCHAFT (DE) 1982-03-09 US disclosed