SCHEMBL9892984

SCHEMBL9892984

COc1ccc(N2C(=O)CCC2C)cc1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.54
TDP1 Q9NUW8 1/20 0.51
ALDH1A1 P00352 4/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
GFER P55789 3/20 0.47
HSD11B1 P28845 2/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
HTR7 P34969 1/20 0.45

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
SCHEMBL11113574 0.81 GLA (0.59) POLBTDP1ALDH1A1L3MBTL1CYP1A2
SCHEMBL9893024 0.81 HCRTR1 (0.43) POLBTDP1L3MBTL1CYP1A2KMT2A
SCHEMBL16480425 0.81 HRH3 (0.43) TDP1ALDH1A1L3MBTL1
SCHEMBL4636834 0.81 GAA (0.46) POLBKMT2AMEN1
SCHEMBL10574183 0.81 TDP1 (0.55) POLBTDP1ALDH1A1L3MBTL1CYP1A2
SCHEMBL9891754 0.80 POLB (0.50) POLBTDP1ALDH1A1L3MBTL1CYP1A2
SCHEMBL16480398 0.80 PTGER2 (0.38) TDP1KMT2A
SCHEMBL25416662 0.79 ALDH1A1 (0.42) ALDH1A1GFERKMT2AMEN1
SCHEMBL10131414 0.79 CYP3A4 (0.41) CYP3A4KMT2AMEN1
SCHEMBL22658820 0.79 SLC6A2 (0.46) TDP1ALDH1A1L3MBTL1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116422367-B Zirconium-silicon molecular sieve encapsulated platinum sub-nanoparticle catalyst and preparation method and application thereof 天津师范大学 2025-01-28 CN claimed
CN-116422367-A Zirconium-silicon molecular sieve encapsulated platinum sub-nanoparticle catalyst and preparation method and application thereof 天津师范大学 2023-07-14 CN claimed
CN-116422367-B Zirconium-silicon molecular sieve encapsulated platinum sub-nanoparticle catalyst and preparation method and application thereof 天津师范大学 2025-01-28 CN disclosed
US-20240051974-A1 DIRECT REDUCTIVE AMINATIONS WITH MONOTRIFLUOROACETOXY BORANE-AMINES PURDUE RESEARCH FOUNDATION (US) 2024-02-15 US disclosed
CN-116422367-A Zirconium-silicon molecular sieve encapsulated platinum sub-nanoparticle catalyst and preparation method and application thereof 天津师范大学 2023-07-14 CN disclosed
US-8629157-B2 Pyrrolidine compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-14 US disclosed
US-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-07 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 (2 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-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 POLB 2879/4885TDP1 4464/4885ALDH1A1 3279/4885
US-20240051974-A1 DIRECT REDUCTIVE AMINATIONS WITH MONOTRIFLUOROACETOXY BORANE-AMINES MAOB, BCAT2, AADAT POLB 80/4885TDP1 2489/4885ALDH1A1 609/4885

“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.