SCHEMBL30385481

SCHEMBL30385481

COC(=O)c1c(-c2c(C)noc2C)n(-c2ccc(O)cc2)c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
HSD17B10 Q99714 4/20 0.47
CYP1A2 P05177 4/20 0.47
CYP3A4 P08684 4/20 0.47
KDM4E B2RXH2 3/20 0.47
ALOX15 P16050 3/20 0.47
PKM P14618 3/20 0.47
HPGD P15428 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP2D6 P10635 1/20 0.47
GAA P10253 2/20 0.44
MAPK1 P28482 2/20 0.43
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TSHR P16473 1/20 0.43
POLB P06746 2/20 0.40
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
GABRP O00591 3/20 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
SCHEMBL1076344 1.00 MAPT (0.47) MAPTHSD17B10CYP1A2CYP3A4KDM4E
SCHEMBL1077008 0.89 ESR1 (0.39) HSD17B10CYP1A2CYP3A4ALOX15HPGD
SCHEMBL2146217 0.88 HPGD (0.43) HSD17B10CYP1A2CYP3A4ALOX15HPGD
SCHEMBL1077169 0.88 GAA (0.44) HSD17B10CYP1A2CYP3A4KDM4EALOX15
SCHEMBL30386360 0.88 HDAC6 (0.40) MAPTHSD17B10CYP1A2CYP3A4KDM4E
SCHEMBL1076740 0.88 HDAC6 (0.40) MAPTHSD17B10CYP1A2CYP3A4KDM4E
SCHEMBL1074111 0.88 ESR1 (0.38) MAPTHSD17B10CYP1A2CYP3A4KDM4E
SCHEMBL30386259 0.88 ESR1 (0.38) MAPTHSD17B10CYP1A2CYP3A4KDM4E
SCHEMBL1075535 0.87 ESR1 (0.39) HSD17B10CYP1A2CYP3A4ALOX15HPGD
SCHEMBL30386550 0.87 ESR1 (0.39) HSD17B10CYP1A2CYP3A4ALOX15HPGD

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-11628146-B2 Estrogen receptor ligand treatment for neurodegenerative diseases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-04-18 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-11628146-B2 Estrogen receptor ligand treatment for neurodegenerative diseases ESR2, ESRRG, ESR1 MAPT 289/4885HSD17B10 782/4885CYP1A2 2051/4885

“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.