SCHEMBL3363763

SCHEMBL3363763

Fc1cc(CBr)c(Br)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.38
KDM1B Q8NB78 3/20 0.38
GPR84 Q9NQS5 1/20 0.35
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HTR2C P28335 5/20 0.32
HTR2B P41595 5/20 0.32
HTR2A P28223 4/20 0.32
SLC6A4 P31645 1/20 0.31
KCNH2 Q12809 1/20 0.31

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
SCHEMBL3365678 0.91 GPR84 (0.35) KDM1AKDM1BGPR84ALDH1A1TDP1
SCHEMBL3875287 0.84 GPR84 (0.38) KDM1AKDM1BGPR84ALDH1A1TDP1
SCHEMBL28786022 0.83 KDM1A (0.36) KDM1AKDM1BGPR84ALDH1A1TDP1
SCHEMBL364604 0.83 KDM1A (0.46) KDM1AKDM1BKCNH2
SCHEMBL30296659 0.83 KDM1A (0.46) KDM1AKDM1BKCNH2
SCHEMBL377235 0.82 KDM1A (0.39) KDM1AKDM1BGPR84ALDH1A1TDP1
SCHEMBL488821 0.82 GPR84 (0.37) KDM1AKDM1BGPR84ALDH1A1TDP1
SCHEMBL30474348 0.82 KDM1A (0.39) KDM1AKDM1BGPR84ALDH1A1TDP1
SCHEMBL3366165 0.81 DPP4 (0.34) KDM1AKDM1BKCNH2
SCHEMBL3367070 0.81 KDM1A (0.37) KDM1AKDM1BGPR84ALDH1A1TDP1

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
US-8324235-B2 Heterocyclic spiro-compounds NOVARTIS AG (CH) 2012-12-04 US disclosed
EP-2134720-B1 HETEROCYCLIC SPIRO-COMPOUNDS NOVARTIS AG (CH) 2010-10-13 EP disclosed
US-20100144774-A1 HETEROCYCLIC SPIRO-COMPOUNDS NOVARTIS AG (CH) 2010-06-10 US disclosed
EP-2134720-A1 HETEROCYCLIC SPIRO-COMPOUNDS Novartis Ag (CH) 2009-12-23 EP disclosed
WO-2008119744-A1 HETEROCYCLIC SPIRO-COMPOUNDS NOVARTIS AG (CH) 2008-10-09 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-20100144774-A1 HETEROCYCLIC SPIRO-COMPOUNDS REN, NR3C2, CYP21A2 KDM1A 3591/4885KDM1B 4113/4885GPR84 2415/4885

“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.