SCHEMBL5702020

SCHEMBL5702020

Cc1cc(C)c(-c2ccccc2C(=O)O)c(C)c1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.73
TTR P02766 2/20 0.54
ALDH1A1 P00352 4/20 0.49
KDM4E B2RXH2 3/20 0.49
USP2 O75604 1/20 0.49
TSHR P16473 1/20 0.49
POLB P06746 3/20 0.47
GAA P10253 2/20 0.47
ALOX15 P16050 1/20 0.46
METAP2 P50579 1/20 0.46
SOS1 Q07889 1/20 0.46
MCL1 Q07820 1/20 0.46
HNF4A P41235 1/20 0.46
LMNA P02545 1/20 0.45

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
SCHEMBL31596348 0.87 MYC (0.55) MYCTTRALDH1A1TSHRPOLB
SCHEMBL9512847 0.85 MYC (1.00) MYCALDH1A1KDM4EUSP2TSHR
SCHEMBL27418584 0.84 MYC (0.53) MYCTTRALDH1A1POLBGAA
SCHEMBL29848458 0.84 MYC (0.53) MYCTTRALDH1A1POLBGAA
SCHEMBL28522305 0.84 MYC (0.56) MYCTTRALDH1A1KDM4EUSP2
SCHEMBL28506849 0.84 MYC (0.51) MYCTTRALDH1A1POLBALOX15
SCHEMBL27645793 0.83 MYC (0.65) MYCTTRALDH1A1KDM4EUSP2
SCHEMBL6702122 0.81 MYC (0.58) MYCALDH1A1KDM4EUSP2TSHR
SCHEMBL28405226 0.81 MYC (0.49) MYCTTRALDH1A1POLBMETAP2
SCHEMBL5735556 0.81 MYC (0.49) MYCTTRALDH1A1POLBMETAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118005704-A Synthesis method of heterocyclic carbon glycoside compound with single configuration 河南大学 2024-05-10 CN claimed
US-11324827-B2 Multifunctionalized polyethylene glycol derivative and preparation method therefor XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2022-05-10 US disclosed
CN-111825733-A Macrolides and methods of making and using the same 哈佛大学的校长及成员们 2020-10-27 CN disclosed
CN-107430127-B Cancer markers and methods of use thereof 中央研究院 2020-08-28 CN disclosed
US-20170312363-A1 MULTIFUNCTIONALIZED POLYETHYLENE GLYCOL DERIVATIVE AND PREPARATION METHOD THEREFOR XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2017-11-02 US disclosed
EP-1681924-A1 BIPHENYL DERIVATIVE OR ITS SALT, AND PESTICIDE CONTAINING IT AS AN ACTIVE INGREDIENT ISHIHARA SANGYO KAISHA, LTD. (JP) 2006-07-26 EP disclosed
WO-2005044007-A1 BIPHENYL DERIVATIVE OR ITS SALT, AND PESTICIDE CONTAINING IT AS AN ACTIVE INGREDIENT ISHIHARA SANGYO KAISHA, LTD. (JP) 2005-05-19 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-11324827-B2 Multifunctionalized polyethylene glycol derivative and preparation method therefor HDGF, F11, F12 MYC 3726/4885TTR 1749/4885ALDH1A1 1582/4885
US-20170312363-A1 MULTIFUNCTIONALIZED POLYETHYLENE GLYCOL DERIVATIVE AND PREPARATION METHOD THEREFOR HDGF, F11, F12 MYC 3726/4885TTR 1749/4885ALDH1A1 1582/4885

“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.