SCHEMBL9907757

SCHEMBL9907757

Cc1cnc(-c2c(F)cccc2Cl)c2cc(C(=O)O)ccc12

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 10/20 0.61
PTGES O14684 2/20 0.43
LMNA P02545 1/20 0.41
GLA P06280 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
ATM Q13315 1/20 0.41
RORC P51449 3/20 0.41
ALDH1A1 P00352 1/20 0.41
SLC22A12 Q96S37 1/20 0.40
TTR P02766 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL9907629 0.92 HTR5A (0.71) HTR5ASLC22A12TTR
SCHEMBL9907663 0.89 HTR5A (0.65) HTR5APTGESRORCSLC22A12TTR
SCHEMBL9907522 0.89 HTR5A (0.72) HTR5APTGESRORCTTR
SCHEMBL9907743 0.88 HTR5A (0.58) HTR5APTGESLMNAGLAHPGD
SCHEMBL9908029 0.86 HTR5A (0.57) HTR5APTGESRORCALDH1A1SLC22A12
SCHEMBL9907762 0.86 HTR5A (0.62) HTR5ARORCSLC22A12
SCHEMBL9907659 0.86 HTR5A (0.64) HTR5ARORCSLC22A12TTR
SCHEMBL9907967 0.85 HTR5A (0.86) HTR5A
SCHEMBL9907658 0.84 HTR5A (0.71) HTR5APTGESRORCTTR
SCHEMBL9907695 0.84 HTR5A (0.65) HTR5APTGESRORCTTR

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 5 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-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
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 US disclosed
WO-2011016504-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE アステラス製薬株式会社 (JP) 2011-02-10 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-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE HTR5A, HTR2A, HTR1E HTR5A 1/4885PTGES 3077/4885LMNA 4287/4885

“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.