SCHEMBL9846384

SCHEMBL9846384

COC(Oc1ccccn1)=C(C(=O)OOc1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.38
LMNA P02545 5/20 0.38
HTT P42858 5/20 0.38
NPSR1 Q6W5P4 3/20 0.38
MITF O75030 2/20 0.38
AGTR1 P30556 1/20 0.38
OPRK1 P41145 1/20 0.38
KDM4E B2RXH2 3/20 0.37
MAPT P10636 3/20 0.37
POLB P06746 1/20 0.37
TDP1 Q9NUW8 3/20 0.37
RAB9A P51151 3/20 0.37
ALDH1A1 P00352 2/20 0.37
F2 P00734 2/20 0.35
F12 P00748 1/20 0.35
TP53 P04637 2/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
PPARG P37231 1/20 0.34
HPGD P15428 2/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL9846325 0.79 L3MBTL1 (0.41) SMN1; SMN2LMNAHTTNPSR1KDM4E
SCHEMBL9846273 0.74 POLB (0.36) LMNAHTTPOLBTDP1RAB9A
SCHEMBL9846369 0.74 KMT2A (0.33) SMN1; SMN2LMNAHTTNPSR1MITF
SCHEMBL28760907 0.72 TSHR (0.46) SMN1; SMN2HTTMAPTTDP1RAB9A
SCHEMBL9846388 0.70 KMT2A (0.38) SMN1; SMN2LMNAHTTNPSR1KDM4E
SCHEMBL9846395 0.70 MAPT (0.39) SMN1; SMN2HTTMAPTF2TSHR
SCHEMBL9846357 0.68 KMT2A (0.41) SMN1; SMN2LMNAMAPTRAB9AALDH1A1
SCHEMBL6206065 0.68 TSHR (0.47) SMN1; SMN2HTTMAPTTDP1RAB9A
SCHEMBL245065 0.67 NPC1 (0.46) SMN1; SMN2LMNAHTTOPRK1KDM4E
SCHEMBL2829058 0.67 LMNA (0.53) SMN1; SMN2LMNAMITFKDM4EMAPT

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-0415569-A2 Agrochemical compositions ZENECA LIMITED (GB) 1991-03-06 EP claimed