SCHEMBL9909267

SCHEMBL9909267

N#Cc1ccc(-c2c(Cl)cnc3ccc(C(=O)O)cc23)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 2/20 0.52
MAP4K4 O95819 2/20 0.46
AR P10275 1/20 0.41
PLAU P00749 2/20 0.40
EGLN2 Q96KS0 1/20 0.40
HTR5A P47898 1/20 0.40
CSNK2A2 P19784 1/20 0.40
CSNK2B P67870 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.39
CDH1 P12830 1/20 0.39
APC P25054 1/20 0.39
CTNNB1 P35222 1/20 0.39
TCF7L2 Q9NQB0 1/20 0.39
IP6K1 Q92551 1/20 0.39
IP6K3 Q96PC2 1/20 0.39
IP6K2 Q9UHH9 1/20 0.39
RPA1 P27694 1/20 0.38
PTPN11 Q06124 1/20 0.38
PRSS12 P56730 1/20 0.38
CSF1R P07333 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
SCHEMBL9909232 0.86 EGLN2 (0.44) SLC22A12MAP4K4ARPLAUEGLN2
SCHEMBL9907501 0.84 IP6K1 (0.49) PLAUHTR5AIP6K1IP6K3IP6K2
SCHEMBL9909249 0.84 HTR5A (0.59) PLAUHTR5AMAP2
SCHEMBL9907568 0.84 IP6K1 (0.52) MAP4K4PLAUHTR5ACSNK2A2CSNK2B
SCHEMBL9907500 0.84 HTR5A (0.52) MAP4K4PLAUHTR5ACSNK2A2CSNK2B
SCHEMBL9909253 0.83 HTR5A (0.55) SLC22A12MAP4K4HTR5AMRGPRX4KDM4C
SCHEMBL12875082 0.82 HTR5A (0.50) SLC22A12MAP4K4PLAUHTR5AMAP2
SCHEMBL9909183 0.81 ALDH1A1 (0.50) MAP4K4PLAUCSNK2A2IP6K1IP6K3
SCHEMBL9907577 0.81 SLC22A12 (0.40) SLC22A12PLAUHTR5ACSNK2A2CSNK2B
SCHEMBL9909265 0.80 PDE5A (0.42) SLC22A12PLAUHTR5AMRGPRX4EIF4EBP1

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
EP-2463276-B1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC (JP) 2014-03-12 EP disclosed
EP-2463276-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2012-06-13 EP 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 SLC22A12 1751/4885MAP4K4 3525/4885AR 815/4885

“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.