SCHEMBL449180

SCHEMBL449180

O=C1CC(c2ccccc2)C1

nearest known ligand 0.82

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.82
GAA P10253 1/20 0.82
BRD4 O60885 3/20 0.50
MAP1LC3B Q9GZQ8 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CTRB1 P17538 1/20 0.48
ALDH1A1 P00352 3/20 0.47
POLB P06746 1/20 0.46
HPGD P15428 1/20 0.46
LMNA P02545 1/20 0.44
SLC18A3 Q16572 1/20 0.44
SIGMAR1 Q99720 1/20 0.44

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
SCHEMBL11482528 0.90 GAA (0.68) MAPTGAABRD4MAP1LC3BMEN1
SCHEMBL20197630 0.90 GAA (0.68) MAPTGAABRD4MAP1LC3BMEN1
SCHEMBL562614 0.90 MAPT (1.00) MAPTGAABRD4MAP1LC3BMEN1
Formic Acid SCHEMBL27499639 0.89 GAA (0.67) MAPTGAABRD4MAP1LC3BMEN1
SCHEMBL29040654 0.83 MAPT (0.84) MAPTGAABRD4MAP1LC3BMEN1
SCHEMBL4864740 0.81 GAA (0.63) MAPTGAABRD4MAPK1POLB
SCHEMBL568689 0.81 GAA (0.63) MAPTGAABRD4MAPK1POLB
SCHEMBL4878591 0.81 GAA (0.63) MAPTGAABRD4MAPK1POLB
SCHEMBL13574408 0.81 GAA (0.74) MAPTGAABRD4MAP1LC3BMEN1
SCHEMBL16581527 0.81 MAPT (0.57) MAPTGAABRD4MAP1LC3BMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115181081-B Synthesis method of beta-phenyl-gamma-butyrolactone 青岛科技大学 2024-05-17 CN claimed
CN-115181081-A Synthesis method of beta-phenyl-gamma-butyrolactone 青岛科技大学 2022-10-14 CN claimed
US-6713435-B2 SUCH AS B-PHENYL-GAMMA-BUTYLOLACTONE VIA OXIDATION OF CYCLIC KETONE (3-PHENYLCYCLOBUTANONE) WITH HYDROGEN PEROXIDE/UREA HYDROGEN PEROXIDE IN PRESENCE OF COBALT/SALEN COMPLEX AS CATALYST KYUSHU UNIVERSITY (JP) 2004-03-30 US claimed
US-20030120091-A1 Method for producing optically active lactone compounds by using salen cobalt complexes having a cis-beta structure KYUSHU UNIVERSITY (JP) 2003-06-26 US claimed
EP-1288210-A2 A method for producing optically active lactone compounds by using salen cobalt complexes having a CIS-Beta structure KYUSHU UNIVERSITY (JP) 2003-03-05 EP claimed
EP-4663640-A1 XANTHINE COMPOUND AND USE THEREOF Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2025-12-17 EP disclosed
WO-2024164818-A1 XANTHINE COMPOUND AND USE THEREOF 中国科学院上海药物研究所 2024-08-15 WO disclosed
CN-118459461-A Xanthine compound and application thereof 中国科学院上海药物研究所 2024-08-09 CN disclosed
US-20240246937-A1 IL4I1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2024-07-25 US disclosed
WO-2024147125-A1 CYCLOBUTYL-SUBSTITUTED PHENOXY-DIOXETANES AND USES THEREOF RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2024-07-11 WO disclosed
WO-2024147125-A1 CYCLOBUTYL-SUBSTITUTED PHENOXY-DIOXETANES AND USES THEREOF RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2024-07-11 WO disclosed
EP-3377473-B1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS INC (US) 2024-06-19 EP disclosed
EP-1288210-A2 A method for producing optically active lactone compounds by using salen cobalt complexes having a CIS-Beta structure KYUSHU UNIVERSITY (JP) 2003-03-05 EP disclosed
EP-1278728-A1 PYRROLIDINE AND PIPERIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2003-01-29 EP disclosed
US-6451819-B2 PYRROLIDINE-3-YL-SULFANYL, OR SUFONYL OR SUFINYL DERIVATIVES USED IN THE TREATMENT OF NEURODEGENERATIVE DISEASES HOFFMANN-LA ROCHE INC. 2002-09-17 US disclosed
US-20010047031-A1 Heterocyclic compounds useful as NMDA receptor selective subtype blockers HOFFMANN-LA ROCHE INC. 2001-11-29 US disclosed
WO-2001081303-A1 PYRROLIDINE AND PIPERIDINE DERIVATIVES AND THEIR USE FOR THE TREAMENT OF NEURODEGENERATIVE DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2001-11-01 WO disclosed
US-6160134-A Process for preparing chiral cyclopropane carboxylic acids and acyl guanidines BRISTOL-MYERS SQUIBB CO. (US) 2000-12-12 US disclosed
US-4035426-A Diarylcyclobutanes MEAD JOHNSON & COMPANY (US) 1977-07-12 US disclosed
US-3939196-A Diarylcyclobutanes MEAD JOHNSON & COMPANY (US) 1976-02-17 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 (3 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-20030120091-A1 Method for producing optically active lactone compounds by using salen cobalt complexes having a cis-beta structure SOD1, OAT, SOD3 MAPT 2241/4885GAA 618/4885BRD4 1452/4885
US-20010047031-A1 Heterocyclic compounds useful as NMDA receptor selective subtype blockers GRIN1, GRM1, GRIN2B MAPT 1856/4885GAA 3423/4885BRD4 1453/4885
US-20240246937-A1 IL4I1 INHIBITORS AND METHODS OF USE IL4I1, IL4, IL2 MAPT 3067/4885GAA 3303/4885BRD4 22/4885

“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.