SCHEMBL2809845

SCHEMBL2809845

Cc1nc(-c2ccc(OCCCCCOc3ccc(C(=N)N)cc3O)cc2)c(CNCCCn2ccnc2)s1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MAPK1 P28482 1/20 0.42
GAA P10253 1/20 0.40
TBXAS1 P24557 3/20 0.39
QPCT Q16769 1/20 0.37
NAMPT P43490 7/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
AKT1 P31749 1/20 0.36
AKT2 P31751 1/20 0.36

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
SCHEMBL727848 0.85 SMN1; SMN2 (0.47) HTTSMN1; SMN2MAPK1GAATBXAS1
SCHEMBL727417 0.79 SMN1; SMN2 (0.46) HTTSMN1; SMN2MAPK1GAATBXAS1
SCHEMBL727667 0.76 NOS1 (0.44) HTTSMN1; SMN2MAPK1GAATBXAS1
SCHEMBL5064080 0.74 SMN1; SMN2 (0.50) HTTSMN1; SMN2MAPK1GAANAMPT
SCHEMBL729321 0.73 CYP19A1 (0.43) HTTSMN1; SMN2MAPK1GAATBXAS1
SCHEMBL729312 0.71 SMN1; SMN2 (0.58) HTTSMN1; SMN2MAPK1GAANAMPT
SCHEMBL5064083 0.70 SMN1; SMN2 (0.57) HTTSMN1; SMN2MAPK1GAANAMPT
SCHEMBL729143 0.70 SMN1; SMN2 (0.45) HTTSMN1; SMN2MAPK1GAATBXAS1
SCHEMBL729141 0.70 MEN1 (0.42)
SCHEMBL727963 0.70 SMN1; SMN2 (0.44) HTTSMN1; SMN2MAPK1GAATBXAS1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100249402-A1 NOVEL BENZAMIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING OSTEPOROSIS COMPRISING THE SAME DONG WHA PHARMACEUTICAL CO. LTD. (KR) 2010-09-30 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-20100249402-A1 NOVEL BENZAMIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING OSTEPOROSIS COMPRISING THE SAME SOST, CTSA, BECN1 HTT 3532/4885SMN1; SMN2 4065/4885MAPK1 1028/4885

“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.