SCHEMBL7407155

SCHEMBL7407155

CC(C)C(C(=O)OCc1ccccc1)N1CCC1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.46
RECQL P46063 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
ATM Q13315 1/20 0.44
ALDH1A1 P00352 5/20 0.44
IL1RN P18510 1/20 0.43
ERAP2 Q6P179 1/20 0.43
ERAP1 Q9NZ08 1/20 0.43
POLB P06746 1/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
ELANE P08246 1/20 0.41

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
SCHEMBL19388177 0.91 ATM (0.44) APOBEC3ARECQLAPOBEC3GATMALDH1A1
SCHEMBL11010892 0.86 CYP3A4 (0.46) ALDH1A1POLBCYP3A4CYP2C9CYP2C19
SCHEMBL25924384 0.86 ATM (0.39) APOBEC3ARECQLAPOBEC3GATMALDH1A1
SCHEMBL7405996 0.85 APOBEC3A (0.39) APOBEC3ARECQLAPOBEC3GALDH1A1POLB
SCHEMBL1289870 0.83 SLC1A2 (0.50) ATMALDH1A1IL1RNERAP2ERAP1
SCHEMBL21960350 0.83 CTSB (0.47) ATMALDH1A1IL1RNERAP2ERAP1
SCHEMBL21960352 0.83 CTSB (0.47) ATMALDH1A1IL1RNERAP2ERAP1
SCHEMBL27058220 0.82 ALDH1A1 (0.42) ATMALDH1A1IL1RNERAP2ERAP1
SCHEMBL3736402 0.81 ALDH1A1 (0.47) ATMALDH1A1IL1RNERAP2ERAP1
SCHEMBL9782615 0.81 ALDH1A1 (0.46) APOBEC3ARECQLAPOBEC3GALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6482827-B1 Matrix metalloproteinase inhibitors PHARMACIA & UPJOHN S.P.A. (IT) 2002-11-19 US disclosed
EP-0925289-A1 MATRIX METALLOPROTEINASE INHIBITORS PHARMACIA & UPJOHN S.p.A. (IT) 1999-06-30 EP disclosed
EP-0920414-A1 MATRIX METALLOPROTEINASE INHIBITORS PHARMACIA & UPJOHN S.p.A. (IT) 1999-06-09 EP disclosed
WO-1999002510-A1 MATRIX METALLOPROTEINASE INHIBITORS PHARMACIA & UPJOHN S.P.A. (IT) 1999-01-21 WO disclosed
WO-1997049674-A1 MATRIX METALLOPROTEINASE INHIBITORS PHARMACIA & UPJOHN S.P.A. (IT) 1997-12-31 WO disclosed