SCHEMBL4444274

SCHEMBL4444274

O=C1COC(COCc2ccccc2)C(c2cc(F)cc(F)c2)N1c1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
REN P00797 4/20 0.35
FFAR4 Q5NUL3 1/20 0.35
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GRM5 P41594 1/20 0.33
KCNA5 P22460 1/20 0.33
CTSG P08311 1/20 0.32
CMA1 P23946 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
UGCG Q16739 1/20 0.32

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
SCHEMBL3582986 1.00 REN (0.35) RENFFAR4NPC1RAB9ASMN1; SMN2
SCHEMBL3594918 0.86 GRM2 (0.35) RENFFAR4LMNA
SCHEMBL3592444 0.83 ALDH1A1 (0.37) FFAR4ALDH1A1LMNA
SCHEMBL3597465 0.81 LMNA (0.37) NPC1RAB9ASMN1; SMN2L3MBTL1GRM5
SCHEMBL3593019 0.77 GRM2 (0.38) RENNPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL3593066 0.74 SOAT1 (0.41) RENALDH1A1
SCHEMBL3587336 0.72 STING1 (0.35) GRM5LMNA
SCHEMBL3592419 0.70 ALDH1A1 (0.34) ALDH1A1LMNA
SCHEMBL3581823 0.69 MDM2 (0.39)
SCHEMBL3589624 0.67 LMNA (0.38) ALDH1A1LMNA

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
EP-2121598-A2 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2009-11-25 EP disclosed
WO-2008076754-A2 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2008-06-26 WO disclosed