SCHEMBL4952809

SCHEMBL4952809

COc1cccc(OCC(=O)N2CCC3(CC2)C(=O)Nc2ccccc23)c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.57
ALDH1A1 P00352 5/20 0.50
LMNA P02545 1/20 0.50
GHSR Q92847 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
USP2 O75604 1/20 0.46
TP53 P04637 1/20 0.46
MAPK1 P28482 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
KDM4E B2RXH2 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HTR7 P34969 1/20 0.44
RECQL P46063 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL4952232 0.91 GHSR (0.57) ALDH1A1LMNAGHSRSMN1; SMN2MAPK1
SCHEMBL4951646 0.88 MEN1 (0.58) GAAALDH1A1LMNAGHSRSMN1; SMN2
SCHEMBL4948679 0.88 MEN1 (0.44) GAALMNAMEN1KMT2AKDM4E
SCHEMBL4948828 0.88 ENPP2 (0.49) GAAALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL4952558 0.88 FKBP1A (0.56) MEN1KMT2AHTR7MAPT
SCHEMBL13996781 0.87 RAB9A (0.58) ALDH1A1LMNAGHSRSMN1; SMN2MEN1
SCHEMBL13996616 0.86 MEN1 (0.43) GAAMAPK1MEN1KMT2AKDM4E
SCHEMBL13996727 0.86 RECQL (0.44) GAAALDH1A1LMNAGHSRSMN1; SMN2
SCHEMBL4955662 0.85 NPC1 (0.60) GAAALDH1A1LMNASMN1; SMN2USP2
SCHEMBL4948674 0.85 L3MBTL1 (0.45) GAASMN1; SMN2USP2MAPK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080306102-A1 NOVEL SPIROOXYINDOLE COMPOUNDS AND DRUGS CONTAINING SAME KOWA CO., LTD. (JP) 2008-12-11 US disclosed
US-20080306102-A1 NOVEL SPIROOXYINDOLE COMPOUNDS AND DRUGS CONTAINING SAME KOWA CO., LTD. (JP) 2008-12-11 US disclosed
US-20080306102-A1 NOVEL SPIROOXYINDOLE COMPOUNDS AND DRUGS CONTAINING SAME KOWA CO., LTD. (JP) 2008-12-11 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-20080306102-A1 NOVEL SPIROOXYINDOLE COMPOUNDS AND DRUGS CONTAINING SAME HSD11B1, HSD11B2, HSD3B1 GAA 2369/4885ALDH1A1 119/4885LMNA 2737/4885

“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.