SCHEMBL9907768

SCHEMBL9907768

Cc1ccccc1-c1ncc(Cl)c2ccc(C(=O)O)cc12

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.52
CSNK2B P67870 1/20 0.52
HTR5A P47898 5/20 0.45
SLC22A12 Q96S37 3/20 0.43
PLAU P00749 3/20 0.42
PLG P00747 1/20 0.42
IGF1R P08069 1/20 0.40
NR1H4 Q96RI1 2/20 0.40
MAP4K4 O95819 1/20 0.40
DHODH Q02127 1/20 0.39
NAPRT Q6XQN6 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
GPBAR1 Q8TDU6 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
SCHEMBL9907662 0.88 HTR5A (0.56) CSNK2A2HTR5ASLC22A12PLAUPLG
SCHEMBL9908016 0.88 HTR5A (0.47) CSNK2A2CSNK2BHTR5ASLC22A12PLAU
SCHEMBL9907758 0.86 HTR5A (0.43) CSNK2A2CSNK2BHTR5AGPBAR1
SCHEMBL9907708 0.86 KDM4C (0.47) CSNK2A2CSNK2BHTR5APLAUPLG
SCHEMBL9908002 0.86 HTR5A (0.45) CSNK2A2CSNK2BHTR5ASLC22A12PLAU
SCHEMBL9907770 0.86 HTR5A (0.55) CSNK2A2CSNK2BHTR5ASLC22A12PLAU
SCHEMBL9907681 0.85 HTR5A (0.56) CSNK2A2CSNK2BHTR5APLAUPLG
SCHEMBL9907739 0.85 HTR5A (0.53) CSNK2A2CSNK2BHTR5ASLC22A12MAP4K4
SCHEMBL9907711 0.85 HTR5A (0.56) CSNK2A2CSNK2BHTR5ANR1H4DHODH
SCHEMBL9908017 0.84 HTR5A (0.54) HTR5APLAUPLG

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 CSNK2A2 4132/4885CSNK2B 4303/4885HTR5A 1/4885

“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.