SCHEMBL7044666

SCHEMBL7044666

COC(=O)c1cc(NSC(=O)N2CCN(c3ccccc3SC)CC2)c(OC)nc1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
GAA P10253 2/20 0.37
CCKAR P32238 1/20 0.36
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MEN1 O00255 2/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.36
MAPT P10636 2/20 0.36
HTR1A P08908 3/20 0.35
DRD2 P14416 3/20 0.35
FAAH O00519 1/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL7041089 0.90 THRB (0.38) KMT2AL3MBTL1NPC1RAB9AKDM4E
SCHEMBL7042006 0.89 RBP4 (0.44) SMN1; SMN2KMT2AL3MBTL1RAB9AGAA
SCHEMBL7042753 0.89 MAPT (0.47) SMN1; SMN2KMT2ANPC1RAB9AGAA
SCHEMBL7041121 0.86 MAPT (0.48) SMN1; SMN2KMT2AL3MBTL1NPC1RAB9A
SCHEMBL6657909 0.86 ALDH1A1 (0.50) SMN1; SMN2KMT2AL3MBTL1GAAKDM4E
SCHEMBL7038717 0.82 KMT2A (0.41) SMN1; SMN2KMT2AL3MBTL1GAACCKAR
SCHEMBL7040077 0.82 MAPT (0.41) SMN1; SMN2KMT2AL3MBTL1NPC1GAA
SCHEMBL7041068 0.82 KMT2A (0.39) SMN1; SMN2KMT2AL3MBTL1NPC1RAB9A
SCHEMBL7044475 0.81 GAA (0.41) SMN1; SMN2KMT2AL3MBTL1GAACCKAR
SCHEMBL7046056 0.80 GAA (0.39) SMN1; SMN2KMT2AL3MBTL1GAACCKAR

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-20030092910-A1 Piperazine derivatives and process for the preparation thereof SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2003-05-15 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-20030092910-A1 Piperazine derivatives and process for the preparation thereof CBR1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCCS SMN1; SMN2 2466/4885KMT2A 2664/4885L3MBTL1 2717/4885

“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.