SCHEMBL2180167

SCHEMBL2180167

CCCCCOc1cnn(Cc2ccccc2Cl)c(=O)c1Cl

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.61
POLB P06746 1/20 0.61
RAB9A P51151 1/20 0.61
BLM P54132 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
GPR35 Q9HC97 1/20 0.61
GAA P10253 1/20 0.46
NPBWR1 P48145 8/20 0.45
ALDH1A1 P00352 2/20 0.44
PKM P14618 1/20 0.42
PKLR P30613 1/20 0.42
CNR2 P34972 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL12408517 0.86 SMN1; SMN2 (0.43) KMT2AMEN1POLBRAB9ABLM
SCHEMBL18980262 0.83 POLB (0.70) KMT2AMEN1POLBRAB9ABLM
SCHEMBL2178807 0.79 KMT2A (0.48) KMT2AMEN1POLBRAB9ABLM
SCHEMBL10642561 0.77 RAB9A (1.00) KMT2AMEN1POLBRAB9ABLM
SCHEMBL18979930 0.76 NPSR1 (0.76) KMT2AMEN1POLBRAB9ABLM
SCHEMBL18979972 0.73 POLB (0.59) KMT2AMEN1POLBRAB9ABLM
SCHEMBL18980164 0.73 RAB9A (0.76) KMT2AMEN1POLBRAB9ABLM
SCHEMBL10366469 0.73 GAA (0.50) KMT2ARAB9ASMN1; SMN2NPSR1GAA
SCHEMBL17099741 0.72 MEN1 (0.73) KMT2AMEN1POLBRAB9ABLM
SCHEMBL19000728 0.71 MEN1 (0.67) KMT2AMEN1POLBRAB9ABLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101282930-B Fab I inhibitor and process for preparing same CRYSTALGENOMICS INC 2012-10-24 CN claimed
CN-101282930-A Fab I inhibitor and process for preparing same CRYSTALGENOMICS INC (KR) 2008-10-08 CN claimed
EP-1948601-A1 FAB I INHIBITOR AND PROCESS FOR PREPARING SAME Crystalgenomics, Inc. (KR) 2008-07-30 EP claimed
US-20070135465-A1 Fab I Inhibitor and Process for Preparing Same CRYSTALGENOMICS, INC. (KR) 2007-06-14 US claimed
WO-2007043835-A1 FAB I INHIBITOR AND PROCESS FOR PREPARING SAME CRYSTALGENOMICS, INC. (KR) 2007-04-19 WO claimed
CN-101282930-B Fab I inhibitor and process for preparing same CRYSTALGENOMICS INC 2012-10-24 CN disclosed
US-7973060-B2 Fab I inhibitor and process for preparing same CRYSTALGENOMICS, INC. (KR) 2011-07-05 US disclosed
CN-101282930-A Fab I inhibitor and process for preparing same CRYSTALGENOMICS INC (KR) 2008-10-08 CN disclosed
EP-1948601-A1 FAB I INHIBITOR AND PROCESS FOR PREPARING SAME Crystalgenomics, Inc. (KR) 2008-07-30 EP disclosed
US-20070135465-A1 Fab I Inhibitor and Process for Preparing Same CRYSTALGENOMICS, INC. (KR) 2007-06-14 US disclosed
WO-2007043835-A1 FAB I INHIBITOR AND PROCESS FOR PREPARING SAME CRYSTALGENOMICS, INC. (KR) 2007-04-19 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 (1 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-20070135465-A1 Fab I Inhibitor and Process for Preparing Same TFPI, TFPI2, FCGRT KMT2A 3342/4885MEN1 3245/4885POLB 1080/4885

“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.