Anisole

Anisole

SCHEMBL250580

COc1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA4 P22748 1/20 0.61
CES2 O00748 1/20 0.53
CES1 P23141 1/20 0.53
LTA4H P09960 1/20 0.52
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
EDNRA P25101 2/20 0.47
EDNRB P24530 1/20 0.47
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
Anisole SCHEMBL7562607 1.00 CA4 (0.61) CA4CES2CES1LTA4HCA1
Anisole SCHEMBL28177334 1.00 CA4 (0.61) CA4CES2CES1LTA4HCA1
Anisole SCHEMBL28145757 1.00 CA4 (0.61) CA4CES2CES1LTA4HCA1
Anisole SCHEMBL2335694 0.92 CA4 (0.52) CA4CES2CES1LTA4HPPARG
Anisole SCHEMBL28945470 0.91 CA4 (0.50) CA4CES2CES1LTA4HPPARG
Anisole SCHEMBL7204405 0.91 CA4 (0.50) CA4CES2CES1LTA4HCA1
1,3-Dimethoxybenzene SCHEMBL11452224 0.88 LMNA (0.58) CES2CES1SMN1; SMN2
Anisole SCHEMBL7444295 0.88 CA4 (0.47) CA4CES2CES1LTA4HCA1
Trifluoroacetic Acid SCHEMBL27892361 0.87 RAB9A (0.50) CES2CES1ALDH1A1
Trifluoroacetic Acid SCHEMBL27598900 0.87 RAB9A (0.50) CES2CES1ALDH1A1

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 195 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7459550-B2 Process for the preparation of Cefditoren ORCHID CHEMICALS & PHARMACEUTICALS LTD. (IN) 2008-12-02 US claimed
EP-1562957-B1 PROCESS FOR THE PREPARATION OF 3-PROPENYL CEPHALOSPORIN DMF SOLVATE ORCHID CHEMICALS & PHARM LTD (IN) 2006-09-13 EP claimed
US-20060173175-A1 Process for the preparation of cefditoren ORCHID CHEMICALS & PHARMACEUTICALS LTD. (IN) 2006-08-03 US claimed
EP-1562957-A1 PROCESS FOR THE PREPARATION OF 3-PROPENYL CEPHALOSPORIN DMF SOLVATE Orchid Chemicals and Pharmaceuticals Ltd (IN) 2005-08-17 EP claimed
US-6903211-B2 Process for the preparation of 3-propenyl cephalosporin DMF solvate ORCHID CHEMICALS & PHARMACEUTICALS LIMITED (IN) 2005-06-07 US claimed
EP-1501839-A2 PROCESS FOR THE PREPARATION OF CEFTIOFUR ACID Orchid Chemicals & Pharmaceuticals Ltd. (IN) 2005-02-02 EP claimed
WO-2005003141-A2 AN IMPROVED PROCESS FOR THE PREPARATION OF CEFDITOREN ORCHID CHEMICALS & PHARMACEUTICALS LTD (IN) 2005-01-13 WO claimed
US-6800756-B2 CONDENSATION; CYCLIZATION ORCHID CHEMICALS AND PHARMACEUTICALS, LTD. (IN) 2004-10-05 US claimed
WO-2004083216-A1 A PROCESS FOR THE PREPARATION OF CEPHALOSPORINS ORCHID CHEMICALS & PHARMACEUTICALS LTD (IN) 2004-09-30 WO claimed
US-20040132995-A1 Process for the preparation of cephalosporins ORCHID CHEMICALS & PHARMACEUTICALS, LTD. (IN) 2004-07-08 US claimed
WO-2004039812-A1 PROCESS FOR THE PREPARATION OF 3-PROPENYL CEPHALOSPORIN DMF SOLVATE ORCHID CHEMICALS & PHARMACEUTICALS LIMITED (IN) 2004-05-13 WO claimed
US-20040087786-A1 Process for the preparation of 3-propenyl cephalosporin DMF solvate ORCHID CHEMICALS & PHARMACEUTICALS LIMITED (IN) 2004-05-06 US claimed
US-20030216567-A1 New method for the preparation of ceftiofur sodium and its intermediates ORCHID CHEMICALS AND PHARMACEUTICALS LIMITED (IN) 2003-11-20 US claimed
WO-2003093278-A2 PROCESS FOR THE PREPARATION OF CEFTIOFUR ACID ORCHID CHEMICALS AND PHARMACEUTICALS LIMITED (IN) 2003-11-13 WO claimed
JP-8245632-A None JP disclosed
EP-3689892-B1 RADIOACTIVE DRUG UNIV CHIBA NAT UNIV CORP (JP) 2024-07-17 EP disclosed
EP-3997520-B1 RINSE AND METHOD OF USE THEREOF FOR REMOVING EDGE PROTECTION LAYERS AND RESIDUAL METAL HARDMASK COMPONENTS MERCK PATENT GMBH (DE) 2023-12-20 EP disclosed
US-3966719-A ANTIBACTERIAL PFIZER INC. (US) 1976-06-29 US disclosed
US-3946001-A BACTERICIDES E. R. SQUIBB & SONS, INC. (US) 1976-03-23 US disclosed
US-3931170-A BACTERICIDE E. R. SQUIBB & SONS, INC. (US) 1976-01-06 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-20040087786-A1 Process for the preparation of 3-propenyl cephalosporin DMF solvate CYP2F1, PEF1, CYP4Z1 CA4 2046/4885CES2 912/4885CES1 365/4885
US-20030216567-A1 New method for the preparation of ceftiofur sodium and its intermediates BLVRB, CBR1, DCXR CA4 340/4885CES2 438/4885CES1 1237/4885
US-20060173175-A1 Process for the preparation of cefditoren DHPS, FDPS, CYP4F2 CA4 1233/4885CES2 176/4885CES1 298/4885
US-20040132995-A1 Process for the preparation of cephalosporins CYP2F1, CYP7A1, MRPL21 CA4 1577/4885CES2 323/4885CES1 46/4885

“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.