SCHEMBL21708412

SCHEMBL21708412

NCC(=O)Oc1ncccc1I

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
RAB9A P51151 1/20 0.34
CARM1 Q86X55 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.33
P2RX7 Q99572 2/20 0.33
NAPRT Q6XQN6 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
CYP19A1 P11511 1/20 0.32
GAA P10253 2/20 0.32
MAPK8 P45983 1/20 0.31
ADORA2A P29274 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL29230750 0.81 RAB9A (0.40) ALDH1A1RAB9ANAPRTTDP1
SCHEMBL27703269 0.77 KDM4E (0.43) ALDH1A1L3MBTL1TDP1LMNA
SCHEMBL28896336 0.76 KDM4E (0.43) ALDH1A1GAASMN1; SMN2
SCHEMBL7414860 0.70 TSHR (0.40) ALDH1A1RAB9AL3MBTL1NAPRTGAA
SCHEMBL6435155 0.68 LMNA (0.49) ALDH1A1L3MBTL1TDP1GAALMNA
SCHEMBL6983292 0.68 LMNA (0.63) ALDH1A1RAB9AL3MBTL1TDP1GAA
SCHEMBL1480240 0.67 HPGD (0.44) ALDH1A1L3MBTL1GAALMNASMN1; SMN2
SCHEMBL27139405 0.67 METAP1 (0.39) RAB9AL3MBTL1TDP1GAASMN1; SMN2
SCHEMBL6980607 0.67 FABP5 (0.46) ALDH1A1L3MBTL1GAALMNASMN1; SMN2
SCHEMBL18989973 0.67 ESR1 (0.39) ALDH1A1RAB9AL3MBTL1P2RX7NAPRT

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-3609887-A1 MESOIONIC IMIDAZOPYRIDINES FOR USE AS INSECTICIDES Bayer Aktiengesellschaft (DE) 2020-02-19 EP disclosed