SCHEMBL148327

SCHEMBL148327

CC[CH]OC(=O)C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
HSD11B1 P28845 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
NAAA Q02083 1/20 0.36
EPHX1 P07099 1/20 0.35
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
ADRB3 P13945 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
MIF P14174 1/20 0.35
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL8582637 1.00 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2CES2CES1HSD11B1
SCHEMBL453057 0.98 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2CES2CES1HSD11B1
SCHEMBL3152795 0.94 SMN1; SMN2 (0.39) ALDH1A1SMN1; SMN2KMT2AADRB2ADRB1
SCHEMBL8694628 0.90
SCHEMBL450922 0.85 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2CES2CES1HSD11B1
SCHEMBL8584525 0.85 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2CES2CES1HSD11B1
SCHEMBL449505 0.82 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2CES2CES1HSD11B1
SCHEMBL9205374 0.81 GABRP (0.42) ALDH1A1SMN1; SMN2POLBKMT2AMEN1
SCHEMBL11041019 0.79 NAAA (0.40) ALDH1A1NAAAEPHX1
SCHEMBL8845360 0.78 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2CES2CES1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130131032-A1 NEUROTHERAPEUTIC TREATMENT FOR SEXUAL DYSFUNCTION REVAAX PHARMACEUTICALS, LLC (US) 2013-05-23 US claimed
US-7355040-B2 Process for the preparation of cephalosporin compounds and synthetic intermediates ZOETIS SERVICES LLC 2008-04-08 US claimed
US-5491167-A INHIBITORS OF CHOLESTEROL BIOSYNTHESIS SANKYO COMPANY, LIMITED (JP) 1996-02-13 US claimed
EP-0338824-A2 Esters of 6-beta-(alpha-oxyimino)-acylamino-penicillanic acid derivatives BEECHAM GROUP PLC (GB) 1989-10-25 EP claimed
US-20240131180-A1 DRUG ANTIBODY CONJUGATES PHARMA MAR, S.A. (ES) 2024-04-25 US disclosed
US-20240115553-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY AZEVAN PHARMACEUTICALS, INC. (US) 2024-04-11 US disclosed
WO-2024064209-A1 COMPOSITIONS AND METHODS FOR TREATING MYCOBACTERIUM INFECTIONS DATA2DISCOVERY, INC. (US) 2024-03-28 WO disclosed
EP-4025253-B1 DRUG ANTIBODY CONJUGATES PHARMA MAR SA (ES) 2024-03-20 EP disclosed
CN-114615999-B Drug antibody conjugates 法马马有限公司 2024-03-08 CN disclosed
US-20230218774-A1 DRUG ANTIBODY CONJUGATES PHARMA MAR, S.A. (ES) 2023-07-13 US disclosed
CN-116327950-A Use of a composition for the treatment of neuropsychiatric symptoms of neurodegenerative diseases 阿泽范药品公司 2023-06-27 CN disclosed
CN-116139282-A Compositions and methods for treating neurodegenerative diseases 阿泽范药品公司 2023-05-23 CN disclosed
US-4835150-A ANTIBIOTICS BEECHAM GROUP P.L.C. (GB) 1989-05-30 US disclosed
US-4820701-A Penam derivatives BEECHAM GROUP P.L.C. (GB) 1989-04-11 US disclosed
EP-0308559-A2 Cephalosporins, process for their preparation, pharmaceutical compositions containing them and intermediates BEECHAM GROUP PLC (GB) 1989-03-29 EP disclosed
US-4816452-A ANTIBIOTICS BEECHAM GROUP P.L.C. (GB) 1989-03-28 US disclosed
EP-0293532-A1 6- or 7-beta-[2-[4-(substituted)-2,3-dioxopiperazin-1-yl) carbonylamino]-(substituted)acetamido]-penicillin and cephalosporin derivatives BEECHAM GROUP PLC (GB) 1988-12-07 EP disclosed
EP-0254582-A2 6 Beta-(alpha-oximino)-acylamino penicillanic-acid derivatives and starting compounds BEECHAM GROUP PLC (GB) 1988-01-27 EP disclosed
EP-0219926-A2 Cephalosporins, processes for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1987-04-29 EP disclosed
US-4477447-A ANTIBIOTIC, BACTERICIDE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-10-16 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-20240115553-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY FABP7, PYGB, CHAT ALDH1A1 1429/4885SMN1; SMN2 114/4885CES2 197/4885
US-20130131032-A1 NEUROTHERAPEUTIC TREATMENT FOR SEXUAL DYSFUNCTION PREP, DNPEP, PRSS12 ALDH1A1 1573/4885SMN1; SMN2 518/4885CES2 95/4885
US-20240131180-A1 DRUG ANTIBODY CONJUGATES STT3B, STT3A, TTL ALDH1A1 785/4885SMN1; SMN2 3089/4885CES2 2410/4885
US-20230218774-A1 DRUG ANTIBODY CONJUGATES B3GAT3, MGAT3, SDAD1 ALDH1A1 162/4885SMN1; SMN2 4523/4885CES2 1874/4885

“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.