SCHEMBL1787467

SCHEMBL1787467

COC(=O)c1cc(-c2ncccn2)ccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.53
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
KDM4E B2RXH2 4/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
MAPT P10636 2/20 0.53
HTT P42858 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44
ALDH1A1 P00352 4/20 0.44
TSHR P16473 1/20 0.44
NOTUM Q6P988 1/20 0.43
GAA P10253 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAP2K1 Q02750 1/20 0.42
ALOX15 P16050 1/20 0.42
CLK4 Q9HAZ1 2/20 0.41
DYRK1A Q13627 1/20 0.41
TDP1 Q9NUW8 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
SCHEMBL27476571 0.84 CYP4F2 (0.55) LMNAKMT2AKDM4ESMN1; SMN2MAPT
SCHEMBL29195744 0.84 P2RX7 (0.55) LMNAMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL1788339 0.84 P2RX7 (0.58) LMNAMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL1786159 0.81 KDM4E (0.44) LMNAMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL1785731 0.80 MEN1 (0.53) LMNAMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL1785281 0.80 MKNK1 (0.47) LMNAKMT2ASMN1; SMN2MAPTHTT
SCHEMBL1785348 0.79 LMNA (0.43) LMNAMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL12482773 0.77 MEN1 (0.57) LMNAMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL4462598 0.77 MEN1 (0.45) LMNAMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL787129 0.76 AKR1C2 (0.54) LMNAMEN1KMT2AKDM4ESMN1; SMN2

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-20130203730-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2013-08-08 US disclosed
EP-2607357-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS Astrazeneca AB (SE) 2013-06-26 EP disclosed
US-20120115845-A1 THERAPEUTIC AGENTS ALLEN JACK MCQUEEN (GB) 2012-05-10 US disclosed
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2011-05-26 US disclosed
EP-2205576-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS AstraZeneca AB (SE) 2010-07-14 EP disclosed
US-20090186870-A1 Therapeutic Agents - 802 ASTRAZENECA AB (SE) 2009-07-23 US disclosed
WO-2009047558-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2009-04-16 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 (4 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-20130203730-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS GPR119, GHSR, GLP1R LMNA 4721/4885MEN1 2250/4885KMT2A 1721/4885
US-20120115845-A1 THERAPEUTIC AGENTS GPR119, MC2R, MC4R LMNA 4327/4885MEN1 692/4885KMT2A 3139/4885
US-20090186870-A1 Therapeutic Agents - 802 GPR119, SLC5A2, MC2R LMNA 4113/4885MEN1 1253/4885KMT2A 2304/4885
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS GPR119, GHSR, GLP1R LMNA 4721/4885MEN1 2250/4885KMT2A 1721/4885

“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.