SCHEMBL9907360

SCHEMBL9907360

Cc1cnc2ccc(C(=O)O)cc2c1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
HTT P42858 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
MAPT P10636 1/20 0.50
IP6K1 Q92551 6/20 0.49
IP6K3 Q96PC2 6/20 0.49
IP6K2 Q9UHH9 6/20 0.49
TP53 P04637 1/20 0.49
HSD17B10 Q99714 1/20 0.49
HPGD P15428 3/20 0.47
KDM4E B2RXH2 3/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
GAA P10253 1/20 0.47
LDHA P00338 2/20 0.46
FABP3 P05413 1/20 0.45
FABP4 P15090 1/20 0.45
PRNP P04156 1/20 0.45
PPARG P37231 1/20 0.45

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
SCHEMBL9907450 0.88 NR4A2 (0.46) ALDH1A1SMN1; SMN2MAPTIP6K1IP6K3
SCHEMBL9907356 0.87 NR1H2 (0.49) ALDH1A1HTTSMN1; SMN2NPSR1MAPT
SCHEMBL9925363 0.87 HDAC3 (0.47) ALDH1A1HTTSMN1; SMN2NPSR1MAPT
SCHEMBL9907798 0.83 HTR5A (0.54) ALDH1A1HTTSMN1; SMN2NPSR1MAPT
SCHEMBL9907501 0.83 IP6K1 (0.49) ALDH1A1HTTSMN1; SMN2NPSR1MAPT
SCHEMBL9907451 0.83 HTR5A (0.49) SMN1; SMN2LMNAMGAM
SCHEMBL9907401 0.82 HTR5A (0.46) ALDH1A1IP6K1IP6K3IP6K2KDM4E
SCHEMBL9907386 0.81 SLC22A12 (0.41) ALDH1A1IP6K1IP6K3IP6K2HPGD
SCHEMBL9907361 0.80 HTR5A (0.49) HTTIP6K1IP6K3IP6K2TP53
SCHEMBL9907568 0.77 IP6K1 (0.52) ALDH1A1HTTSMN1; SMN2NPSR1MAPT

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 6 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
EP-2463276-B1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC (JP) 2014-03-12 EP 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 ALDH1A1 1799/4885HTT 970/4885SMN1; SMN2 3684/4885

“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.