SCHEMBL24738867

SCHEMBL24738867

O=C(O)[C@H]1C[C@]1(F)c1cccc(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.52
HTR2A P28223 1/20 0.52
HTR2B P41595 1/20 0.52
HSD11B1 P28845 1/20 0.45
CCR2 P41597 1/20 0.41
ERCC5 P28715 1/20 0.40
FEN1 P39748 1/20 0.40
KDM1A O60341 3/20 0.39
GRIN2B Q13224 1/20 0.39
HCAR3 P49019 1/20 0.39
HCAR2 Q8TDS4 1/20 0.39
NOTUM Q6P988 1/20 0.38
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
MAOB P27338 4/20 0.37
MAOA P21397 3/20 0.37
CNR2 P34972 1/20 0.37

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
SCHEMBL29880256 0.86 HTR2C (0.55) HTR2CHTR2AHTR2BHSD11B1CCR2
SCHEMBL29302262 0.86 HTR2C (0.55) HTR2CHTR2AHTR2BHSD11B1CCR2
SCHEMBL301325 0.81 MAOB (0.55) HTR2CHTR2AHTR2BHSD11B1KDM1A
SCHEMBL2833213 0.80 MAOB (0.56) HSD11B1CCR2KDM1AMAOBMAOA
SCHEMBL29878836 0.79 HTR2C (0.48) HTR2CHTR2AHTR2BHSD11B1ALDH1A1
SCHEMBL24738866 0.79 HTR2C (0.48) HTR2CHTR2AHTR2BHSD11B1ALDH1A1
SCHEMBL11083629 0.78 HSD11B1 (0.45) HTR2CHTR2AHTR2BHSD11B1CCR2
SCHEMBL11083627 0.78 HSD11B1 (0.45) HTR2CHTR2AHTR2BHSD11B1CCR2
SCHEMBL29302947 0.75 HSD11B1 (0.42) HTR2CHTR2AHTR2BHSD11B1CCR2
SCHEMBL29879558 0.75 HSD11B1 (0.42) HTR2CHTR2AHTR2BHSD11B1CCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228488-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN TAKEDA PHARMACEUTICALS CO (JP) 2024-07-11 US disclosed
US-20240228488-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN TAKEDA PHARMACEUTICALS CO (JP) 2024-07-11 US disclosed
WO-2022197758-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2022-09-22 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-20240228488-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN KLKB1, KLK5, KLK1 HTR2C 3558/4885HTR2A 3223/4885HTR2B 2736/4885

“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.