SCHEMBL5868698

SCHEMBL5868698

C1CC(CNC2CCNCC2)CCN1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 8/20 0.44
MAOB P27338 3/20 0.44
MAOA P21397 2/20 0.44
GNAI3 P08754 3/20 0.44
GNAO1 P09471 3/20 0.44
GNAI1 P63096 3/20 0.44
KCNH2 Q12809 1/20 0.41
ALOX15 P16050 2/20 0.40
TSHR P16473 1/20 0.40
EPHX1 P07099 2/20 0.39
KDM1B Q8NB78 1/20 0.39
SOS1 Q07889 1/20 0.39
ANPEP P15144 1/20 0.39
ERAP2 Q6P179 1/20 0.39
DPP7 Q9UHL4 1/20 0.39
EPHX2 P34913 1/20 0.36

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
SCHEMBL1009313 0.95 GNAI3 (0.44) KDM1AMAOBMAOAGNAI3GNAO1
SCHEMBL19366459 0.95 KDM1A (0.44) KDM1AMAOBMAOAGNAI3GNAO1
Hydrochloric Acid SCHEMBL4796821 0.93 GNAI3 (0.47) KDM1AMAOBMAOAGNAI3GNAO1
SCHEMBL27804953 0.91 GNAI3 (0.41) KDM1AMAOBMAOAGNAI3GNAO1
SCHEMBL3307772 0.91 GNAI3 (0.41) KDM1AMAOBMAOAGNAI3GNAO1
SCHEMBL2673338 0.89 EPHX1 (0.44) KDM1AMAOBMAOAGNAI3GNAO1
SCHEMBL13838034 0.89 RAD52 (0.47) KDM1AMAOBMAOAGNAI3GNAO1
SCHEMBL27911707 0.87 KDM1A (0.44) KDM1AMAOBMAOAGNAI3GNAO1
SCHEMBL5868679 0.85 GNAI3 (0.38) KDM1AMAOBMAOAGNAI3GNAO1
SCHEMBL1587227 0.85 GNAI3 (0.38) KDM1AMAOBMAOAGNAI3GNAO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7098219-B2 Quinolone derivatives WOCKHART LIMITED (IN) 2006-08-29 US disclosed
EP-1305048-A2 INHIBITORS OF CELLULAR EFFLUX PUMPS OF MICROBES Wockhardt Limited (IN) 2003-05-02 EP disclosed
US-20020177559-A1 Quinolone derivatives WOCKHARDT LIMITED 2002-11-28 US disclosed
WO-2002009758-A2 INHIBITORS OF CELLULAR EFFLUX PUMPS OF MICROBES WOCKHARDT LIMITED (IN) 2002-02-07 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-20020177559-A1 Quinolone derivatives ABCB11, ABCB1, ABCG2 KDM1A 3785/4885MAOB 1563/4885MAOA 1829/4885

“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.