SCHEMBL3366563

SCHEMBL3366563

OCc1cc(Cl)c(F)cc1Br

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.34
ALDH1A1 P00352 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
KDM1A O60341 2/20 0.30
KDM1B Q8NB78 2/20 0.30

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
SCHEMBL3367070 0.92 KDM1A (0.37) GPR84ALDH1A1TDP1KDM1AKDM1B
SCHEMBL3366594 0.84 GPR84 (0.33) GPR84
SCHEMBL707949 0.82 KDM1A (0.32) KDM1AKDM1B
SCHEMBL29387214 0.82 KDM1A (0.32) KDM1AKDM1B
SCHEMBL3367771 0.82 AHR (0.36)
SCHEMBL3365678 0.81 GPR84 (0.35) GPR84ALDH1A1TDP1KDM1AKDM1B
SCHEMBL1315873 0.80 CBFB (0.31)
SCHEMBL31614825 0.80 NPC1 (0.31)
SCHEMBL6192193 0.80 GPR84 (0.37) GPR84ALDH1A1TDP1KDM1AKDM1B
SCHEMBL14573871 0.80 GPR84 (0.37) GPR84ALDH1A1TDP1KDM1AKDM1B

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 6 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
CN-101711252-A heterocyclic spiro-compounds NOVARTIS AG 2010-05-19 CN 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 GPR84 2415/4885ALDH1A1 229/4885TDP1 3242/4885

“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.