SCHEMBL506231

SCHEMBL506231

CC=C1C(=O)CC2(CC1=O)CC(=O)C(=CC)C(=O)C2

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL60469 0.81 ALDH1A1 (0.47) ALDH1A1MAPTL3MBTL1
SCHEMBL13167192 0.73
SCHEMBL21954835 0.69 SMN1; SMN2 (0.41) ALDH1A1MAPTL3MBTL1
SCHEMBL18871426 0.69 SMN1; SMN2 (0.46) ALDH1A1MAPTL3MBTL1
SCHEMBL21675668 0.61 SMN1; SMN2 (0.31)
SCHEMBL581954 0.58 ALDH1A1 (0.46) ALDH1A1MAPTL3MBTL1
SCHEMBL18871416 0.58 ALDH1A1 (0.46) ALDH1A1MAPTL3MBTL1
SCHEMBL3650457 0.58
SCHEMBL23332523 0.57 CA1 (0.36) ALDH1A1L3MBTL1
SCHEMBL13615467 0.57 MAPT (0.45) ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4780319-A DRUG DELIVERY USING POLYORTHOESTERS COATINGS MERCK & CO., INC. (US) 1988-10-25 US claimed
US-11357756-B2 Anesthetic compositions and methods comprising imidazoline compounds WARSAW ORTHOPEDIC, INC. (US) 2022-06-14 US disclosed
US-RE48948-E1 Clonidine compounds in a biodegradable polymer WARSAW ORTHOPEDIC, INC. (US) 2022-03-01 US disclosed
EP-2945568-B1 CLONIDINE COMPOUNDS IN A BIODEGRADABLE FIBER WARSAW ORTHOPEDIC INC (US) 2020-08-19 EP disclosed
US-10363238-B2 Methods and compositions to enhance bone growth comprising a statin WARSAW ORTHOPEDIC, INC. (US) 2019-07-30 US disclosed
EP-2276467-B1 ALPHA AND BETA ADRENERGIC RECEPTOR AGONISTS FOR TREATMENT OF PAIN AND/OR INFLAMMATION WARSAW ORTHOPEDIC INC (US) 2018-11-07 EP disclosed
WO-2018136787-A1 ANESTHETIC COMPOSITIONS AND METHODS COMPRISING IMIDAZOLINE COMPOUNDS WARSAW ORTHOPEDIC, INC. (US) 2018-07-26 WO disclosed
US-20180207133-A1 ANESTHETIC COMPOSITIONS AND METHODS COMPRISING IMIDAZOLINE COMPOUNDS WARSAW ORTHOPEDIC, INC. 2018-07-26 US disclosed
US-9968572-B2 Clonidine and GABA compounds in a biodegradable polymer carrier WARSAW ORTHOPEDIC, INC. (US) 2018-05-15 US disclosed
US-9867910-B2 Clonidine compounds in a biodegradable fiber WARSAW ORTHOPEDIC, INC. (US) 2018-01-16 US disclosed
US-20090263448-A1 Clonidine Formulation in a Polyorthoester Carrier WARSAW ORTHOPEDIC, INC. (US) 2009-10-22 US disclosed
US-20090263461-A1 ALPHA ADRENERGIC RECEPTOR AGONISTS FOR TREATMENT OF DEGENERATIVE DISC DISEASE WARSAW ORTHOPEDIC, INC. (US) 2009-10-22 US disclosed
US-20090264490-A1 CLONIDINE FORMULATIONS IN A BIODEGRADABLE POLYMER CARRIER WARSAW ORTHOPEDIC, INC. (US) 2009-10-22 US disclosed
US-20090263462-A1 Methods for Treating Conditions Such as Dystonia and Post-Stroke Spasticity with Clonidine WARSAW ORTHOPEDIC, INC. (US) 2009-10-22 US disclosed
US-20090208554-A1 Baclofen Formulation in a Polyorthoester Carrier MEDTRONIC, INC. (US) 2009-08-20 US disclosed
US-20090202604-A1 Benzodiazepine Formulation in a Polyorthoester Carrier MEDTRONIC, INC. (US) 2009-08-13 US disclosed
US-20090202436-A1 Bupivacaine Formulation in a Polyorthoester Carrier MEDTRONIC, INC. (US) 2009-08-13 US disclosed
EP-2042538-A1 Amphiphilic copolymers and compositions containing such polymers Nirvana's Tree House (NL) 2009-04-01 EP disclosed
WO-2009037313-A1 AMPHIPHILIC COPOLYMERS AND COMPOSITIONS CONTAINING SUCH POLYMERS NIRVANA'S TREE HOUSE B.V. (NL) 2009-03-26 WO disclosed
US-4549010-A Bioerodible poly(ortho ester) thermoplastic elastomer from diketene diacetal MERCK & CO., INC. (US) 1985-10-22 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 (8 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-20090202436-A1 Bupivacaine Formulation in a Polyorthoester Carrier SBDS, SPAST, PRPH ALDH1A1 840/4885MAPT 1659/4885L3MBTL1 571/4885
US-20090208554-A1 Baclofen Formulation in a Polyorthoester Carrier SLC6A13, SUCNR1, GABBR2 ALDH1A1 417/4885MAPT 1776/4885L3MBTL1 1055/4885
US-20090263462-A1 Methods for Treating Conditions Such as Dystonia and Post-Stroke Spasticity with Clonidine GABRA5, SMN1; SMN2, MUSK ALDH1A1 3177/4885MAPT 500/4885L3MBTL1 2250/4885
US-11357756-B2 Anesthetic compositions and methods comprising imidazoline compounds OPRK1, ADRA2C, ADRB2 ALDH1A1 2483/4885MAPT 1892/4885L3MBTL1 1640/4885
US-20090263448-A1 Clonidine Formulation in a Polyorthoester Carrier SNCA, SMN1; SMN2, SPAST ALDH1A1 1043/4885MAPT 1239/4885L3MBTL1 513/4885
US-20090264490-A1 CLONIDINE FORMULATIONS IN A BIODEGRADABLE POLYMER CARRIER SMN1; SMN2, SNCA, NGF ALDH1A1 1408/4885MAPT 617/4885L3MBTL1 861/4885
US-20180207133-A1 ANESTHETIC COMPOSITIONS AND METHODS COMPRISING IMIDAZOLINE COMPOUNDS OPRK1, ADRA2C, ADRB2 ALDH1A1 2483/4885MAPT 1892/4885L3MBTL1 1640/4885
US-20090202604-A1 Benzodiazepine Formulation in a Polyorthoester Carrier GABRD, GABRA1, GABRA2 ALDH1A1 552/4885MAPT 2053/4885L3MBTL1 1520/4885

“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.