SCHEMBL7865382

SCHEMBL7865382

CC1(C)OC2C(OCc3ccccc3)C(CO)(CO)O[C@@H]2O1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
IDO1 P14902 1/20 0.34
GSTP1 P09211 2/20 0.34
GLB1 P16278 1/20 0.33
BCHE P06276 1/20 0.33
PDPK1 O15530 1/20 0.33
MTOR P42345 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 1/20 0.33
OPRM1 P35372 2/20 0.32
OPRL1 P41146 2/20 0.32
GRM2 Q14416 1/20 0.32
GRM3 Q14832 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA4 P43681 1/20 0.32

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
SCHEMBL5846547 1.00 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AIDO1GSTP1
SCHEMBL6839631 1.00 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AIDO1GSTP1
SCHEMBL14929223 1.00 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AIDO1GSTP1
SCHEMBL18568726 1.00 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AIDO1GSTP1
SCHEMBL10158814 1.00 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AIDO1GSTP1
SCHEMBL24371821 1.00 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AIDO1GSTP1
SCHEMBL2308101 1.00 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AIDO1GSTP1
SCHEMBL1096325 1.00 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AIDO1GSTP1
SCHEMBL10158905 0.94 ALDH1A1 (0.36) ALDH1A1MEN1KMT2AIDO1GSTP1
SCHEMBL10158790 0.94 ALDH1A1 (0.36) ALDH1A1MEN1KMT2AIDO1GSTP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6316581-B1 FOR IMPLANTABLE TIME-RELEASE DEVICE, ENCAPSULATION DEVICE GROSS RICHARD A (US) 2001-11-13 US claimed
US-20210379253-A1 IMMOBILISED BIOLOGICAL ENTITIES CARMEDA AB (SE) 2021-12-09 US disclosed
US-20210308283-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF MODERNA THERAPEUTICS, INC. 2021-10-07 US disclosed
WO-2020070258-A1 IMMOBILISED BIOLOGICAL ENTITIES CARMEDA AB (SE) 2020-04-09 WO disclosed
WO-2018035050-A1 PURE HEPTASULFATED DISACCHARIDES HAVING IMPROVED ORAL BIOAVAILABILITY OPKO PHARMACEUTICALS, LLC (US) 2018-02-22 WO disclosed
US-6316581-B1 FOR IMPLANTABLE TIME-RELEASE DEVICE, ENCAPSULATION DEVICE GROSS RICHARD A (US) 2001-11-13 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-20210308283-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ADAR, NT5C3B, NSUN2 ALDH1A1 2620/4885MEN1 2176/4885KMT2A 1675/4885

“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.