SCHEMBL9907623

SCHEMBL9907623

Cc1cc(F)c(-c2c(C)c(C)nc3ccc(C(=O)O)cc23)c(F)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 2/20 0.62
TDP1 Q9NUW8 3/20 0.51
IP6K1 Q92551 3/20 0.44
IP6K3 Q96PC2 3/20 0.44
IP6K2 Q9UHH9 3/20 0.44
ALDH1A1 P00352 4/20 0.43
HPGD P15428 4/20 0.43
KDM4E B2RXH2 4/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
POLB P06746 3/20 0.43
HTT P42858 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
USP2 O75604 1/20 0.43
APOBEC3A P31941 1/20 0.43
YWHAG P61981 1/20 0.43
HSD17B10 Q99714 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL9907608 0.92 HTR5A (0.72) HTR5ATDP1IP6K1IP6K3IP6K2
SCHEMBL9907615 0.89 HTR5A (0.59) HTR5ATDP1IP6K1IP6K3IP6K2
SCHEMBL9907738 0.88 HTR5A (0.58) HTR5ATDP1IP6K1IP6K3IP6K2
SCHEMBL9909245 0.87 HTR5A (0.57) HTR5ATDP1ALDH1A1HPGDKDM4E
SCHEMBL9907618 0.85 HTR5A (0.55) HTR5AALDH1A1HPGDKDM4EL3MBTL1
SCHEMBL9907894 0.84 HTR5A (0.87) HTR5A
SCHEMBL9907657 0.83 HTR5A (0.56) HTR5ATDP1IP6K1IP6K3IP6K2
SCHEMBL9907579 0.82 LMNA (0.54) HTR5ATDP1ALDH1A1HPGDKDM4E
SCHEMBL9907631 0.81 HTR5A (0.51) HTR5ATDP1ALDH1A1HPGDKDM4E
SCHEMBL9907620 0.81 HTR5A (0.53) HTR5ATDP1IP6K1IP6K3IP6K2

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 2 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-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 US 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 1/4885TDP1 964/4885IP6K1 4169/4885

“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.