SCHEMBL3459720

SCHEMBL3459720

N[C@H]1CCc2cc(F)cc(F)c21

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
EPAS1 Q99814 1/20 0.33
KDM1A O60341 3/20 0.32
ANPEP P15144 3/20 0.32
KCNH2 Q12809 2/20 0.31
KDM1B Q8NB78 1/20 0.31
DRD2 P14416 1/20 0.30
DRD3 P35462 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
SCHEMBL8614271 1.00 CYP11B1 (0.38) CYP11B1CYP11B2HTR2AHTR2CEPAS1
Hydrochloric Acid SCHEMBL8614165 0.98 CYP11B1 (0.37) CYP11B1CYP11B2HTR2AHTR2CEPAS1
SCHEMBL12501555 0.81 CYP11B1 (0.36) CYP11B1CYP11B2KDM1AANPEPKCNH2
SCHEMBL16290335 0.81 CYP11B1 (0.36) CYP11B1CYP11B2KDM1AANPEPKDM1B
SCHEMBL31034383 0.81 CYP11B1 (0.36) CYP11B1CYP11B2KDM1AANPEPKCNH2
SCHEMBL16290385 0.81 HTR2A (0.34) CYP11B1CYP11B2HTR2AHTR2CEPAS1
SCHEMBL16290348 0.81 CYP11B1 (0.33) CYP11B1CYP11B2EPAS1KDM1AANPEP
SCHEMBL23136253 0.76 HTR2A (0.36) HTR2AHTR2C
SCHEMBL326748 0.76 CYP11B1 (0.38) CYP11B1CYP11B2HTR2AHTR2CEPAS1
SCHEMBL1150762 0.72 DRD2 (0.49) CYP11B1CYP11B2HTR2CANPEPDRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12559464-B2 Quinazolinone dione compounds and uses thereof EDGEWISE THERAPEUTICS, INC. (US) 2026-02-24 US disclosed
EP-4688756-A1 QUINAZOLINE DIONE COMPOUNDS AND USES THEREOF EDGEWISE THERAPEUTICS, INC. (US) 2026-02-11 EP disclosed
US-20250026726-A1 QUINAZOLINONE DIONE COMPOUNDS AND USES THEREOF EDGEWISE THERAPEUTICS, INC. 2025-01-23 US disclosed
WO-2024206345-A1 QUINAZOLINE DIONE COMPOUNDS AND USES THEREOF EDGEWISE THERAPEUTICS, INC. (US) 2024-10-03 WO disclosed
EP-1501514-B1 PROTEIN KINASE MODULATORS AND METHODS OF USE EXELIXIS INC (US) 2012-12-19 EP disclosed
US-7704995-B2 Protein kinase modulators and methods of use EXELIXIS, INC. (US) 2010-04-27 US disclosed
US-20060211709-A1 Protein kinase modulators and methods of use EXELIXIS, INC. 2006-09-21 US 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 (3 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-20060211709-A1 Protein kinase modulators and methods of use GRK2, MAP4K2, MAPKAPK2 CYP11B1 2469/4885CYP11B2 2270/4885HTR2A 128/4885
US-20250026726-A1 QUINAZOLINONE DIONE COMPOUNDS AND USES THEREOF TNNI3, TNNT2, MYLK2 CYP11B1 324/4885CYP11B2 213/4885HTR2A 763/4885
US-12559464-B2 Quinazolinone dione compounds and uses thereof TNNI3, TNNT2, TNNC1 CYP11B1 25/4885CYP11B2 64/4885HTR2A 920/4885

“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.