SCHEMBL4880124

SCHEMBL4880124

CCc1cc2c(c(CC)c1O)C(=O)CC1(COC1)O2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
PTPN1 P18031 3/20 0.34
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 3/20 0.31
NPC1 O15118 2/20 0.31
HTT P42858 2/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
APEX1 P27695 1/20 0.31
GAA P10253 2/20 0.31
GLA P06280 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TSHR P16473 1/20 0.30
MAOA P21397 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL4462461 0.87 KDM4E (0.40) ALDH1A1PTPN1KMT2AKDM4EHTT
SCHEMBL4883198 0.86 HDAC3 (0.37) ALDH1A1PTPN1KMT2AKDM4ENPC1
SCHEMBL4697608 0.75 CTSB (0.31)
SCHEMBL4473238 0.74 KDM4E (0.43) ALDH1A1PTPN1KMT2AKDM4ENPC1
SCHEMBL4698253 0.73
SCHEMBL4463487 0.71 KDM4E (0.30) KDM4E
SCHEMBL4463485 0.71 KDM4E (0.30) KDM4E
SCHEMBL4468166 0.69 KDM4E (0.32) ALDH1A1KMT2AKDM4EHPGD
SCHEMBL4468728 0.69 KDM4E (0.30) ALDH1A1KDM4EHPGD
SCHEMBL4471135 0.69 KDM4E (0.30) ALDH1A1KDM4EHPGD

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-20080207588-A1 Spiro-Heterocyclic Chromans, Thiochromans and Dihydroquinolines CHU DANIEL T W 2008-08-28 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-20080207588-A1 Spiro-Heterocyclic Chromans, Thiochromans and Dihydroquinolines CBR3, CBR1, DHRS9 ALDH1A1 354/4885PTPN1 995/4885KMT2A 3253/4885

“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.