SCHEMBL9907635

SCHEMBL9907635

COC(=O)c1ccc2c(F)cnc(-c3c(C)cccc3F)c2c1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 14/20 0.59
IL2 P60568 3/20 0.39
NR1H2 P55055 1/20 0.38
NOTUM Q6P988 1/20 0.38

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
SCHEMBL9907517 0.93 HTR5A (0.63) HTR5A
SCHEMBL9907753 0.90 HTR5A (0.59) HTR5ANR1H2
SCHEMBL9907656 0.90 HTR5A (0.61) HTR5ANR1H2
SCHEMBL9907628 0.88 HTR5A (0.67) HTR5AIL2NR1H2NOTUM
SCHEMBL9907516 0.87 HTR5A (0.67) HTR5ANR1H2
SCHEMBL9104780 0.87 HTR5A (0.72) HTR5A
SCHEMBL9907638 0.87 HTR5A (0.62) HTR5A
SCHEMBL9907702 0.85 HTR5A (0.53) HTR5AIL2
SCHEMBL9907691 0.85 HTR5A (0.60) HTR5ANR1H2
SCHEMBL9107764 0.84 HTR5A (0.53) HTR5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853242-B2 Nitrogenous-ring acylguanidine derivative ASTELLAS PHARMA INC. (JP) 2014-10-07 US disclosed
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 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 (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-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE HTR5A, HTR2A, HTR1E HTR5A 1/4885IL2 3643/4885NR1H2 705/4885

“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.