SCHEMBL980653

SCHEMBL980653

CC(Br)C(=O)c1ccc(O[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PREP P48147 4/20 0.42
ALDH1A1 P00352 3/20 0.41
CYP1A2 P05177 2/20 0.41
CA12 O43570 4/20 0.40
CA1 P00915 4/20 0.40
CA9 Q16790 4/20 0.40
SLC2A1 P11166 2/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP2C9 P11712 1/20 0.36
KMT2A Q03164 1/20 0.35
ELANE P08246 2/20 0.34
PARP10 Q53GL7 1/20 0.34
GSK3B P49841 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
SCHEMBL6655342 0.82 SLC2A1 (0.41) PREPALDH1A1CYP1A2CA12CA1
SCHEMBL2500559 0.81 ELANE (0.52) PREPCA12CA1CA9LMNA
SCHEMBL8699124 0.81 MAPT (0.40) PREPALDH1A1CYP1A2LMNAHTT
SCHEMBL8379284 0.81 PREP (0.40) PREPALDH1A1CYP1A2CA12CA1
SCHEMBL2099038 0.80 ALDH1A1 (0.42) ALDH1A1CYP1A2LMNAHTTSMN1; SMN2
SCHEMBL6542930 0.80 CA1 (0.52) PREPALDH1A1CA12CA1CA9
SCHEMBL936407 0.80 MAPT (0.53) PREPALDH1A1CA12CA1CA9
SCHEMBL8382753 0.79 TRPA1 (0.44) PREPALDH1A1CYP1A2CA12CA1
SCHEMBL8644671 0.79 PREP (0.37) PREPALDH1A1CYP1A2CA12CA1
SCHEMBL12339125 0.78 PARP10 (0.53) PREPALDH1A1CA12CA1CA9

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024238396-A1 NMDA LIGAND CONJUGATED COMPOUNDS AND USES THEREOF ADARX PHARMACEUTICALS, INC. (US) 2024-11-21 WO disclosed
US-7875626-B2 3,3,3-trifluoropropane-1-sulfonic acid 4-[1-(2-chlorophenyl)-3-methyl-4-oxo-5-piperidin-1-yl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine-2-yl]phenyl ester; treatment of obesity, psychiatric and neurological disorders ASTRAZENECA AB (SE) 2011-01-25 US disclosed
EP-1937679-B1 PREPARATION AND USE OF TETRAHYDROPYRROLO [3, 2-C] PYRIDIN-4-ONE DERIVATIVES FOR TREATMENT OF OBESITY, PSYCHIATRIC AND NEUROLOGICAL DISORDERS ASTRAZENECA AB (SE) 2009-08-19 EP disclosed
US-7576095-B2 Therapeutic agents ASTRAZENECA AB (SE) 2009-08-18 US disclosed
US-20080312269-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-12-18 US disclosed
US-20080214611-A1 Pharmaceutical Compositions - 659 ASTRAZENECA AB (SE) 2008-09-04 US disclosed
WO-2008096151-A1 PHARMACEUTICAL COMPOSITIONS OF CB1 MODULATORS ASTRAZENECA AB (SE) 2008-08-14 WO disclosed
US-20080009513-A1 Therapeutic agents ASTRAZENECA AB (SE) 2008-01-10 US disclosed
US-5710168-A 2-piperidino-1-alkanol derivatives as neuroprotective agents PFIZER INC. (US) 1998-01-20 US disclosed
US-5527912-A USEFUL INTREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS PFIZER INC. (US) 1996-06-18 US disclosed
US-5391742-A Intermediates for 2-piperidino-1-alkanols PFIZER INC. (US) 1995-02-21 US disclosed
US-5338754-A 2-pyrrolidino-1-alkanol derivatives as antiischemic agents PFIZER INC (US) 1994-08-16 US disclosed
US-5272160-A 2-piperidino-1-alkanol derivatives as antiischemic agents PFIZER INC (US) 1993-12-21 US disclosed
US-5185343-A NORTROPYL-1-ALKANOL DERIVATIVES AS ANTIISCHEMIC AGENTS PFIZER INC. (US) 1993-02-09 US disclosed
WO-1990014087-A1 2-PIPERIDINO-1-ALKANOL DERIVATIVES AS ANTIISCHEMIC AGENTS PFIZER INC. (US) 1990-11-29 WO disclosed
WO-1990014088-A1 2-PIPERIDINO-1-ALKANOL DERIVATIVES AS ANTIISCHEMIC AGENTS PFIZER INC. (US) 1990-11-29 WO disclosed
EP-0398578-A2 2-piperidino-1-alkanol derivatives as antiischemic agents PFIZER INC. (US) 1990-11-22 EP 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-20080009513-A1 Therapeutic agents NLN, GPR119, FABP4 PREP 1416/4885ALDH1A1 403/4885CYP1A2 749/4885
US-20080312269-A1 Therapeutic Agents NLN, GRIN2C, GPR119 PREP 1565/4885ALDH1A1 612/4885CYP1A2 1230/4885
US-20080214611-A1 Pharmaceutical Compositions - 659 CNR1, CNR2, GPR18 PREP 2578/4885ALDH1A1 4335/4885CYP1A2 1018/4885

“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.