SCHEMBL18118971

SCHEMBL18118971

CC(C)(C)c1cccc(Oc2cccc(C(C)(C)C)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
SOD1 P00441 1/20 0.47
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HDAC4 P56524 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
KIF11 P52732 1/20 0.44
ALDH1A1 P00352 3/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 1/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
RAF1 P04049 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41

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
SCHEMBL15576545 0.98 CYP3A4 (0.57) CYP3A4CYP2C9CYP2C19SOD1LMNA
SCHEMBL5671239 0.94 CYP2C9 (0.54) CYP3A4CYP2C9CYP2C19SOD1LMNA
SCHEMBL13474891 0.92 MAPT (0.57) CYP3A4CYP2C9CYP2C19SOD1LMNA
SCHEMBL25906303 0.90 CYP3A4 (0.51) CYP3A4CYP2C9CYP2C19SOD1LMNA
SCHEMBL13009187 0.90 SMN1; SMN2 (0.55) CYP3A4CYP2C9CYP2C19SOD1LMNA
SCHEMBL12879327 0.90 ALDH1A1 (0.55) CYP3A4CYP2C9CYP2C19SOD1LMNA
SCHEMBL13216570 0.90 CYP2C9 (0.51) CYP3A4CYP2C9CYP2C19POLBL3MBTL1
SCHEMBL278328 0.88 LTA4H (0.55) CYP3A4CYP2C9CYP2C19SOD1LMNA
SCHEMBL18210658 0.88 CYP3A4 (0.50) CYP3A4CYP2C9CYP2C19SOD1LMNA
SCHEMBL31563610 0.88 MAOB (0.60) CYP3A4CYP2C9CYP2C19SOD1LMNA

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-117986095-A Preparation method of m-tert-butyl phenetole 中国药科大学 2024-05-07 CN disclosed
CN-114315530-B Preparation process of m-tert-butylphenol and synthesis method of etoxazole 永农生物科学有限公司 2024-03-15 CN disclosed
US-11027242-B2 Nanofiltration membranes and methods of use NOVOMER, INC. (US) 2021-06-08 US disclosed
WO-2020135687-A1 BORON-CONTAINING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 江苏三月光电科技有限公司 2020-07-02 WO disclosed
US-20190255488-A1 NANOFILTRATION MEMBRANES AND METHODS OF USE NOVOMER, INC. (US) 2019-08-22 US disclosed
US-10245559-B2 Nanofiltration membranes and methods of use NOVOMER, INC. (US) 2019-04-02 US disclosed
US-20160288057-A1 NANOFILTRATION MEMBRANES AND METHODS OF USE NOVOMER, INC. (US) 2016-10-06 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 (4 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-10245559-B2 Nanofiltration membranes and methods of use MLEC, EPCAM, LNPK CYP3A4 787/4885CYP2C9 930/4885CYP2C19 1776/4885
US-20190255488-A1 NANOFILTRATION MEMBRANES AND METHODS OF USE MLEC, EPCAM, LNPK CYP3A4 787/4885CYP2C9 930/4885CYP2C19 1776/4885
US-11027242-B2 Nanofiltration membranes and methods of use MLEC, EPCAM, LNPK CYP3A4 787/4885CYP2C9 930/4885CYP2C19 1776/4885
US-20160288057-A1 NANOFILTRATION MEMBRANES AND METHODS OF USE MLEC, EPCAM, LNPK CYP3A4 787/4885CYP2C9 930/4885CYP2C19 1776/4885

“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.