SCHEMBL212452

SCHEMBL212452

O=C(CN1CCN(C(=O)O)CC1)Nc1cccc(Cl)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNT1 Q5JUK3 1/20 0.60
MAPT P10636 2/20 0.59
TSHR P16473 2/20 0.59
KDM4E B2RXH2 1/20 0.59
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
ALDH1A1 P00352 3/20 0.59
KDR P35968 1/20 0.59
POLB P06746 1/20 0.58
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
DRD4 P21917 1/20 0.55
ATM Q13315 1/20 0.54
LMNA P02545 2/20 0.54

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
SCHEMBL7282380 0.83 POLB (0.59) KCNT1MAPTTSHRSMN1; SMN2ALDH1A1
SCHEMBL7445611 0.83 POLB (0.59) KCNT1MAPTTSHRSMN1; SMN2ALDH1A1
SCHEMBL211276 0.82 KCNT1 (0.56) KCNT1MAPTTSHRKDM4ENPC1
SCHEMBL26498839 0.82 CACNA1H (0.62) KCNT1MAPTTSHRALDH1A1KDR
SCHEMBL22217664 0.82 MEN1 (0.78) MAPTTSHRKDM4ENPC1RAB9A
SCHEMBL15332217 0.79 DRD4 (0.61) KCNT1MAPTSMN1; SMN2ALDH1A1KDR
Trifluoroacetic Acid SCHEMBL211386 0.78 SLC2A1 (0.57) KCNT1MAPTTSHRALDH1A1KDR
SCHEMBL4006313 0.77 THRB (0.77) MAPTTSHRKDM4ESMN1; SMN2ALDH1A1
SCHEMBL7291617 0.77 MEN1 (0.59) MAPTTSHRKDM4EKDRMEN1
SCHEMBL10837268 0.77 MEN1 (0.59) MAPTTSHRKDM4EKDRMEN1

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
EP-1963315-B1 ENZYME INHIBITORS CANCER REC TECH LTD (GB) 2014-10-08 EP disclosed
US-8088761-B2 Enzyme inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2012-01-03 US disclosed
US-20090247507-A1 Enzyme Inhibitors THE INSTITUTE OF CANCER RESEARCH (GB) 2009-10-01 US disclosed
EP-1963315-A2 ENZYME INHIBITORS The Institute of Cancer Research (GB) 2008-09-03 EP disclosed
WO-2007072017-A2 ENZYME INHIBITORS THE INSTITUTE OF CANCER RESEARCH (GB) 2007-06-28 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-20090247507-A1 Enzyme Inhibitors AURKC, AURKB, AURKA KCNT1 210/4885MAPT 2154/4885TSHR 2859/4885

“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.