SCHEMBL21593288

SCHEMBL21593288

O=C1c2c(cc(Br)cc2OC(F)F)CCN1CC(F)F

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
NFKB1 P19838 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
HIF1A Q16665 1/20 0.33
SIK2 Q9H0K1 2/20 0.31
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
LMNA P02545 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
PMP22 Q01453 1/20 0.31
GFER P55789 1/20 0.31
KDM4E B2RXH2 1/20 0.30
GLA P06280 1/20 0.30
HTT P42858 1/20 0.30
RAB9A P51151 1/20 0.30
EZH2 Q15910 1/20 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
SCHEMBL21593443 0.88 SIK2 (0.41) CYP1A2CYP3A4CYP2D6NFKB1HTR2A
SCHEMBL32691424 0.85 SIK2 (0.36) SIK2
SCHEMBL32691523 0.85 SIK2 (0.44) SIK2
SCHEMBL21591071 0.82 HTR2A (0.35) CYP1A2CYP3A4CYP2D6NFKB1HTR2A
SCHEMBL21593335 0.78 MAOA (0.34) SIK2
SCHEMBL26438239 0.75 SIK2 (0.46) CYP1A2CYP3A4CYP2D6NFKB1HTR2A
SCHEMBL23725700 0.72 HTR2A (0.35) CYP1A2CYP3A4CYP2D6NFKB1HTR2A
SCHEMBL25664494 0.72 HTR2A (0.37) CYP1A2CYP3A4CYP2D6NFKB1HTR2A
SCHEMBL21593328 0.71 SIK2 (0.41) SIK2EZH2
SCHEMBL21593330 0.70 SIK2 (0.58) SIK2

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-12264156-B2 Compounds and pharmaceutical compositions thereof for the treatment of diseases GALAPAGOS NV (BE) 2025-04-01 US disclosed
US-20220402911-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF DISEASES GALAPAGOS NV (BE) 2022-12-22 US disclosed
US-20220402911-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF DISEASES GALAPAGOS NV (BE) 2022-12-22 US disclosed
WO-2019238424-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF DISEASES GALAPAGOS NV (BE) 2019-12-19 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-20220402911-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF DISEASES IL1A, TNF, IL6 CYP1A2 737/4885CYP3A4 2143/4885CYP2D6 543/4885
US-12264156-B2 Compounds and pharmaceutical compositions thereof for the treatment of diseases TNF, IL1A, COL1A1 CYP1A2 683/4885CYP3A4 2011/4885CYP2D6 544/4885

“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.