SCHEMBL8168248

SCHEMBL8168248

COC(=O)[C@H]1O[C@@H]1c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.67
EPHX1 P07099 3/20 0.56
POLB P06746 1/20 0.51
CYP2D6 P10635 1/20 0.48
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
ITGA4 P13612 1/20 0.47
SLC6A3 Q01959 3/20 0.47
SLC6A4 P31645 2/20 0.47
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 1/20 0.46
BACE1 P56817 1/20 0.44
ATM Q13315 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
SLC6A2 P23975 1/20 0.42

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
SCHEMBL10001744 1.00 TSHR (0.67) TSHREPHX1POLBCYP2D6ALDH1A1
SCHEMBL487564 1.00 TSHR (0.67) TSHREPHX1POLBCYP2D6ALDH1A1
SCHEMBL9543017 1.00 TSHR (0.67) TSHREPHX1POLBCYP2D6ALDH1A1
SCHEMBL487563 1.00 TSHR (0.67) TSHREPHX1POLBCYP2D6ALDH1A1
SCHEMBL6233713 1.00 TSHR (0.67) TSHREPHX1POLBCYP2D6ALDH1A1
SCHEMBL10001742 1.00 TSHR (0.67) TSHREPHX1POLBCYP2D6ALDH1A1
SCHEMBL1692429 1.00 TSHR (0.67) TSHREPHX1POLBCYP2D6ALDH1A1
SCHEMBL16477739 0.90 EPHX1 (0.61) TSHREPHX1POLBCYP2D6ALDH1A1
SCHEMBL15446214 0.87 TSHR (0.53) TSHREPHX1POLBALDH1A1MAPT
SCHEMBL7902731 0.85 TSHR (0.54) TSHREPHX1ALDH1A1MAPTITGA4

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-20230242569-A1 PHOSPHOROUS (V)-BASED REAGENTS, PROCESSES FOR THE PREPARATION THEREOF, AND THEIR USE IN MAKING STEREO-DEFINED ORGANOPHOSHOROUS (V) COMPOUNDS THE SCRIPPS RESEARCH INSTITUTE 2023-08-03 US disclosed
US-20030207935-A1 Novel optically active clausenamides, process of the preparation thereof, pharmaceutical composition containing the same and their medical use INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES 2003-11-06 US disclosed
WO-1993010076-A1 SYNTHESIS AND OPTICAL RESOLUTION OF THE TAXOL SIDE CHAIN AND RELATED COMPOUNDS THE UNIVERSITY OF MISSISSIPPI (US) 1993-05-27 WO 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 (2 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-20230242569-A1 PHOSPHOROUS (V)-BASED REAGENTS, PROCESSES FOR THE PREPARATION THEREOF, AND THEIR USE IN MAKING STEREO-DEFINED ORGANOPHOSHOROUS (V) COMPOUNDS PPIP5K2, INPP5B, PTMS TSHR 3913/4885EPHX1 1633/4885POLB 1692/4885
US-20030207935-A1 Novel optically active clausenamides, process of the preparation thereof, pharmaceutical composition containing the same and their medical use HIF1AN, HIF1A, CLN6 TSHR 4724/4885EPHX1 455/4885POLB 3261/4885

“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.