SCHEMBL11016331

SCHEMBL11016331

Cc1cc(N)ccc1SCC(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
PDE10A Q9Y233 1/20 0.38
CASP1 P29466 3/20 0.36
TSHR P16473 3/20 0.34
CYP3A4 P08684 2/20 0.34
MAPT P10636 4/20 0.34
KDM4E B2RXH2 3/20 0.34
MEN1 O00255 2/20 0.34
THRB P10828 2/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 2/20 0.34
ALOX15 P16050 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GAA P10253 3/20 0.33
GLA P06280 1/20 0.33
POLB P06746 1/20 0.33
NR4A1 P22736 1/20 0.32
PTK2B Q14289 1/20 0.32
RAD52 P43351 1/20 0.31
GFER P55789 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
SCHEMBL14387228 0.86 ALDH1A1 (0.42) ALDH1A1PDE10ACASP1TSHRCYP3A4
SCHEMBL28149572 0.81 LMNA (0.40) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL24377911 0.80 HTT (0.31)
SCHEMBL11015942 0.80 TSHR (0.34) ALDH1A1TSHRKDM4EGAAGLA
SCHEMBL11016102 0.79 PDE7A (0.49) ALDH1A1CASP1TSHRCYP3A4MAPT
SCHEMBL10873981 0.79 ESR2 (0.34) ALDH1A1TSHRCYP3A4MAPTMEN1
SCHEMBL16676184 0.77 ALDH1A1 (0.48) ALDH1A1PDE10ACASP1TSHRCYP3A4
SCHEMBL915895 0.76 CYP3A4 (0.41) ALDH1A1TSHRCYP3A4ALOX15
SCHEMBL18856709 0.76 ALDH1A1 (0.47) ALDH1A1PDE10ACASP1TSHRCYP3A4
SCHEMBL15058765 0.75 CYP3A4 (0.42) ALDH1A1CASP1TSHRCYP3A4KDM4E

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
EP-0143302-A2 Benzoylurea derivatives and intermediates NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1985-06-05 EP disclosed