SCHEMBL626318

SCHEMBL626318

NC(=O)N1CCN(Cc2cc(Cl)cc(Cl)c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.53
PKM P14618 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
ATM Q13315 1/20 0.47
AKR1C3 P42330 1/20 0.47
HTR1A P08908 1/20 0.46
HTR2A P28223 1/20 0.46
HTR7 P34969 1/20 0.46
HTR6 P50406 1/20 0.46
FAAH O00519 2/20 0.46
POLB P06746 1/20 0.46
HRH3 Q9Y5N1 1/20 0.45
GPR183 P32249 1/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SIGMAR1 Q99720 1/20 0.44

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
SCHEMBL2932454 0.85 L3MBTL1 (0.54) L3MBTL1PKMNPSR1ATMAKR1C3
SCHEMBL2784148 0.85 AKR1C3 (0.63) AKR1C3FAAHPOLBHRH3GPR183
SCHEMBL3222136 0.79 ALDH1A1 (0.66) L3MBTL1FAAHMEN1LMNATSHR
SCHEMBL15265471 0.78 GPR183 (0.50) L3MBTL1PKMNPSR1ATMFAAH
SCHEMBL626776 0.78 MAPT (0.44) PKMNPSR1HTR1AHTR2AHTR7
SCHEMBL2784552 0.77 GPR183 (0.62) NPSR1FAAHPOLBHRH3GPR183
SCHEMBL20570029 0.76 ATM (0.47) L3MBTL1PKMNPSR1ATMAKR1C3
SCHEMBL12538869 0.76 KDR (0.52) L3MBTL1ATMHRH3MEN1LMNA
SCHEMBL16759532 0.76 STS (0.55) L3MBTL1NPSR1POLBMEN1MAPK1
SCHEMBL10070588 0.75 ALDH1A1 (0.59) L3MBTL1PKMNPSR1ATMAKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2393829-A1 ACTAGARDINE DERIVATIVES Novacta Biosystems Limited (GB) 2011-12-14 EP claimed
WO-2010089544-A1 ACTAGARDINE DERIVATIVES NOVACTA BIOSYSTEMS LIMITED (GB) 2010-08-12 WO claimed
US-9192569-B2 Formulations for infusion of type B lantibiotics NOVACTA BIOSYSTEMS LIMITED (GB) 2015-11-24 US disclosed
US-8729031-B2 Compounds NOVACTA BIOSYSTEMS LIMITED (GB) 2014-05-20 US disclosed
EP-2603204-A2 FORMULATIONS FOR INFUSION OF TYPE B LANTIBIOTICS Novacta Biosystems Limited (GB) 2013-06-19 EP disclosed
US-20130137630-A1 FORMULATIONS FOR INFUSION OF TYPE B LANTIBIOTICS NOVACTA BIOSYSTEMS LIMITED (GB) 2013-05-30 US disclosed
WO-2012020219-A2 FORMULATIONS FOR INFUSION OF TYPE B LANTIBIOTICS NOVACTA BIOSYSTEMS LIMITED (GB) 2012-02-16 WO disclosed
EP-2393829-A1 ACTAGARDINE DERIVATIVES Novacta Biosystems Limited (GB) 2011-12-14 EP disclosed
US-20110294723-A1 Compounds NOVACTA BIOSYSTEMS LIMITED (GB) 2011-12-01 US disclosed
WO-2010089544-A1 ACTAGARDINE DERIVATIVES NOVACTA BIOSYSTEMS LIMITED (GB) 2010-08-12 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 (2 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-20130137630-A1 FORMULATIONS FOR INFUSION OF TYPE B LANTIBIOTICS SLC5A2, SLC5A11, SPTSSB L3MBTL1 1645/4885PKM 2298/4885NPSR1 2108/4885
US-20110294723-A1 Compounds SLC11A2, SDHA, SDHB L3MBTL1 4346/4885PKM 1999/4885NPSR1 1670/4885

“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.