SCHEMBL13879657

SCHEMBL13879657

CN(C)C(=O)N1CCC(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cn3)oc3cccnc23)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 6/20 0.47
▸ SMN1; SMN2 Q16637 5/20 0.46
▸ RAB9A P51151 3/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ LMNA P02545 3/20 0.40
▸ TSHR P16473 2/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ GAA P10253 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39
▸ RELA Q04206 1/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ NCOA3 Q9Y6Q9 1/20 0.38

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
SCHEMBL13664965 0.89 SMN1; SMN2 (0.55) F10SMN1; SMN2LMNATSHRALOX15
SCHEMBL13290428 0.88 F10 (0.61) F10SMN1; SMN2RAB9AMAPK1LMNA
SCHEMBL2953281 0.88 SMN1; SMN2 (0.48) F10SMN1; SMN2RAB9ALMNATSHR
SCHEMBL2953282 0.88 SMN1; SMN2 (0.48) F10SMN1; SMN2RAB9ALMNATSHR
SCHEMBL13290955 0.88 SMN1; SMN2 (0.44) F10SMN1; SMN2RAB9AMAPK1LMNA
SCHEMBL13290946 0.87 SMN1; SMN2 (0.43) F10SMN1; SMN2RAB9AMAPK1LMNA
SCHEMBL2950971 0.86 SMN1; SMN2 (0.48) F10SMN1; SMN2RAB9ALMNATSHR
SCHEMBL2950956 0.86 SMN1; SMN2 (0.48) F10SMN1; SMN2RAB9ALMNATSHR
SCHEMBL13291017 0.86 F10 (0.47) F10SMN1; SMN2RAB9AMAPK1LMNA
SCHEMBL13290417 0.86 SMN1; SMN2 (0.46) F10SMN1; SMN2RAB9ALMNATSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7514449-B2 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-04-07 — — US disclosed
US-7514449-B2 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-04-07 — — US disclosed
Send feedback