SCHEMBL4387472

SCHEMBL4387472

O=Cc1cc(Cl)c2ccccc2n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
MAPT P10636 4/20 0.44
KDM4E B2RXH2 3/20 0.44
POLB P06746 2/20 0.44
RAB9A P51151 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP1A2 P05177 1/20 0.40
ERN1 O75460 1/20 0.40
ALDH1A1 P00352 2/20 0.40
GRM2 Q14416 3/20 0.38
GUSB P08236 3/20 0.38
C1R P00736 1/20 0.38
BACE1 P56817 1/20 0.38
NPC1 O15118 1/20 0.38
CASP3 P42574 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
MEN1 O00255 1/20 0.38
GLA P06280 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
SCHEMBL31428642 1.00 MAOA (0.45) MAOAMAOBMAPTKDM4EPOLB
SCHEMBL18740730 0.81 MAOA (0.45) MAOAMAOBMAPTKDM4EPOLB
SCHEMBL11761585 0.80 POLB (0.47) POLBALDH1A1C1RKMT2ATDP1
SCHEMBL3085387 0.79 KDM4E (0.67) MAPTKDM4EPOLBRAB9AL3MBTL1
SCHEMBL7417644 0.79 KDM4E (0.45) MAOAMAOBMAPTKDM4EPOLB
SCHEMBL6534285 0.79 KDM4E (0.66) MAOAMAOBMAPTKDM4EPOLB
SCHEMBL6534280 0.79 KDM4E (0.66) MAOAMAOBMAPTKDM4EPOLB
SCHEMBL29951387 0.78 ERN1 (0.47) MAPTKDM4EPOLBRAB9AL3MBTL1
SCHEMBL27260118 0.78 TERT (0.43) MAOAMAOBCYP1A2ALDH1A1GUSB
SCHEMBL9071311 0.78 ERN1 (0.47) MAPTKDM4EPOLBRAB9AL3MBTL1

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
US-20090011977-A1 Novel Lipopeptides as Antibacterial Agents HILL JASON 2009-01-08 US disclosed
US-20080287347-A1 Novel Lipopeptides as Antibacterial Agents CUBIST PHARMACEUTICALS, INC. 2008-11-20 US disclosed
US-7408025-B2 Lipopeptides as antibacterial agents CUBIST PHARMACEUTICALS, INC. (US) 2008-08-05 US disclosed
US-20040067878-A1 Novel lipopeptides as antibacterial agents MERCK SHARP & DOHME CORP. 2004-04-08 US disclosed
CN-1423656-A Lipopeptides as antibacterial agents CUBIST PHARM INC (US) 2003-06-11 CN disclosed
EP-1246838-A1 LIPOPEPTIDES AS ANTIBACTERIAL AGENTS Cubist Pharmaceuticals, Inc. (US) 2002-10-09 EP disclosed
WO-2001044274-A1 LIPOPEPTIDES AS ANTIBACTERIAL AGENTS CUBIST PHARMACEUTICALS, INC. (US) 2001-06-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080287347-A1 Novel Lipopeptides as Antibacterial Agents CLPTM1, NGLY1, VIP MAOA 3950/4885MAOB 3672/4885MAPT 4381/4885
US-20040067878-A1 Novel lipopeptides as antibacterial agents CLPTM1, NGLY1, VIP MAOA 3950/4885MAOB 3672/4885MAPT 4381/4885
US-20090011977-A1 Novel Lipopeptides as Antibacterial Agents CLPTM1, NGLY1, VIP MAOA 3950/4885MAOB 3672/4885MAPT 4381/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.