SCHEMBL9907448

SCHEMBL9907448

Cc1cnc2ccc(C(=O)O)cc2c1-c1ccc(Cl)cc1F

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 1/20 0.47
KMO O15229 2/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.40
PTGFR P43088 1/20 0.40
KDM4C Q9H3R0 1/20 0.40
KDM5B Q9UGL1 1/20 0.40
GRM2 Q14416 1/20 0.40
SRD5A1 P18405 1/20 0.39
SRD5A2 P31213 1/20 0.39
ADH5 P11766 1/20 0.39
FABP3 P05413 1/20 0.39
FABP4 P15090 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
SCHEMBL9907438 0.88 SRD5A2 (0.45) HTR5ASMN1; SMN2MAPTALDH1A1CYP3A4
SCHEMBL9907400 0.88 HTR5A (0.54) HTR5AKMOKDM4CKDM5BADH5
SCHEMBL9907441 0.88 HTR5A (0.45) HTR5ALMNASMN1; SMN2MAPT
SCHEMBL9907830 0.85 HTR5A (0.68) HTR5A
SCHEMBL9907451 0.84 HTR5A (0.49) HTR5ALMNASMN1; SMN2PTGFR
SCHEMBL9907449 0.84 HTR5A (0.50) HTR5AGRM2
SCHEMBL9907481 0.83 HTR5A (0.40) HTR5ALMNASMN1; SMN2ALDH1A1PTGFR
SCHEMBL9907599 0.81 HTR5A (0.58) HTR5AMAPTALDH1A1PTGFRGRM2
SCHEMBL9907575 0.81 HTR5A (0.47) HTR5AMAPTALDH1A1CYP3A4KDM4C
SCHEMBL9907401 0.79 HTR5A (0.46) HTR5AALDH1A1

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 1/4885KMO 559/4885LMNA 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.