SCHEMBL21026148

SCHEMBL21026148

Cc1nc2ccc(C(C)C)cc2n1CCN1CCCC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
HTR7 P34969 1/20 0.47
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TMEM97 Q5BJF2 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
P2RX7 Q99572 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HTR1D P28221 1/20 0.41
HTR1B P28222 1/20 0.41
SPHK1 Q9NYA1 1/20 0.39
KCNH2 Q12809 1/20 0.39
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
GAA P10253 1/20 0.38
MCHR1 Q99705 1/20 0.38
KDM4E B2RXH2 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
SCHEMBL21026144 0.84 LMNA (0.56) LMNAALDH1A1P2RX7MEN1KMT2A
SCHEMBL18731438 0.83 LMNA (0.53) LMNAHTR7P2RX7MEN1KMT2A
SCHEMBL18732121 0.81 LMNA (0.51) LMNAHTR7L3MBTL1SIGMAR1P2RX7
SCHEMBL3757039 0.76 LMNA (0.74) LMNAHTTSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL17678058 0.74 P2RX7 (0.46) LMNAHTR7ALDH1A1L3MBTL1SIGMAR1
SCHEMBL13677547 0.74 LMNA (0.51) LMNASMN1; SMN2ALDH1A1KDM4ERAB9A
SCHEMBL21026042 0.73 LMNA (0.46) LMNAL3MBTL1P2RX7MEN1KMT2A
SCHEMBL21026066 0.72 HTR7 (0.51) LMNAHTR7HTTSMN1; SMN2ALDH1A1
SCHEMBL21026142 0.72 KDM4E (0.49) LMNASMN1; SMN2ALDH1A1TMEM97SIGMAR1
SCHEMBL17678061 0.71 LMNA (0.66) LMNAHTTALDH1A1L3MBTL1GAA

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-20190151312-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. 2019-05-23 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-20190151312-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES HPSE, GAA, MAN2B1 LMNA 2070/4885HTR7 3188/4885HTT 245/4885

“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.