SCHEMBL10692310

SCHEMBL10692310

Cc1ccc(I)c(N)c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
NOS3 P29474 3/20 0.36
NOS2 P35228 3/20 0.36
ALDH1A1 P00352 4/20 0.35
TDP1 Q9NUW8 2/20 0.33
CASP1 P29466 2/20 0.33
CD44 P16070 1/20 0.33
NOS1 P29475 1/20 0.32
CYP3A4 P08684 4/20 0.32
TSHR P16473 4/20 0.32
PIK3CA P42336 1/20 0.32
TP53 P04637 1/20 0.32
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 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
SCHEMBL10211845 0.83 POLB (0.36) POLBCD44CYP3A4TSHRPIK3CA
SCHEMBL1016986 0.79 POLB (0.56) POLBNOS3NOS2ALDH1A1TDP1
SCHEMBL394750 0.77 POLB (0.68) POLBNOS3NOS2ALDH1A1TDP1
SCHEMBL27750347 0.75 ALDH1A1 (0.38) POLBALDH1A1TDP1CASP1TSHR
SCHEMBL8527219 0.75 CYP1A2 (0.35) POLBTSHRCYP1A2CYP2A6TDP2
SCHEMBL2391846 0.73 CA1 (0.33) MAPTMEN1KMT2A
SCHEMBL29674771 0.73 CA1 (0.33) MAPTMEN1KMT2A
Ammonia Solution, Strong SCHEMBL6571726 0.72 CYP1A2 (0.33) POLBTSHRCYP1A2CYP2A6TDP2
SCHEMBL29366969 0.72 POLB (0.48) POLBNOS3NOS2ALDH1A1TDP1
SCHEMBL6858668 0.72 CYP1A2 (0.33) POLBTSHRCYP1A2CYP2A6TDP2

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-0252603-A2 Adhesives for ceramics and processes for the bonding of ceramics using same MITSUI SEKIYU KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-01-13 EP disclosed