SCHEMBL5700924

SCHEMBL5700924

CCOC(=O)CCc1ccc(N)cn1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.46
CYP4A11 Q02928 3/20 0.46
LMNA P02545 4/20 0.42
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 1/20 0.42
MAOA P21397 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TNF P01375 2/20 0.42
MAPT P10636 1/20 0.41
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 3/20 0.40
HPGD P15428 1/20 0.40
PPIB P23284 1/20 0.40
PPIA P62937 1/20 0.40
PPID Q08752 1/20 0.40
PPIG Q13427 1/20 0.40
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL6750668 0.90 CYP4F2 (0.48) CYP4F2CYP4A11LMNACYP1A2CYP3A4
SCHEMBL16283828 0.84 CYP4F2 (0.49) CYP4F2CYP4A11LMNASMN1; SMN2MAPT
SCHEMBL2635600 0.84 SMN1; SMN2 (0.51) LMNACYP1A2CYP3A4MAOASMN1; SMN2
SCHEMBL2080801 0.83 CYP4F2 (0.47) CYP4F2CYP4A11LMNAMAPTALDH1A1
SCHEMBL29241125 0.82 CYP4F2 (0.46) CYP4F2CYP4A11LMNAMAPTALDH1A1
SCHEMBL15136243 0.82 CYP4F2 (0.46) CYP4F2CYP4A11LMNASMN1; SMN2MAPT
SCHEMBL16278189 0.82 CYP4F2 (0.46) CYP4F2CYP4A11LMNACYP1A2CYP3A4
SCHEMBL3299826 0.82 CYP4F2 (0.46) CYP4F2CYP4A11LMNACYP1A2MAPT
SCHEMBL23361879 0.81 MAPT (0.53) CYP4F2CYP4A11MAPT
SCHEMBL1410678 0.81 CYP4F2 (0.56) CYP4F2CYP4A11LMNAMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1027328-B1 SUBSTITUTED ANILIDES AVENTIS PHARMA LTD (GB) 2006-08-23 EP disclosed
US-6479519-B1 INHIBITORS OF CELL ADHESION; TREATMENT OF ASTHMA OR INFLAMMATORY BOWEL DISEASE AVENTIS PHARMA LIMITED (GB) 2002-11-12 US disclosed
CN-1327443-A Substituted anilide compounds ARVENTIS PHARMACEUTICALS CO LT (GB) 2001-12-19 CN disclosed
EP-1027328-A1 SUBSTITUTED ANILIDES Aventis Pharma Limited (GB) 2000-08-16 EP disclosed
WO-1999023063-A1 SUBSTITUTED ANILIDES AVENTIS PHARMA LIMITED (GB) 1999-05-14 WO disclosed
US-4216318-A HISTAMINE HZ-ANTAGONISTS, ISOCYTOSINES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1980-08-05 US disclosed
US-4154834-A HETEROCYCLIC-(THIO)ALKYLAMINO SUBSTITUTED-4-PYRIMIDONE OR -THIONES SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1979-05-15 US disclosed