SCHEMBL23754685

SCHEMBL23754685

CC1(C)CCC(=O)N1CO

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AOC2 O75106 3/20 0.35
TSHR P16473 1/20 0.32
MAOB P27338 1/20 0.32
KDM4E B2RXH2 1/20 0.31
P2RX7 Q99572 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL7286911 0.83 AOC2 (0.34) AOC2TSHRMAOBKDM4EALDH1A1
SCHEMBL26415058 0.80 P2RX7 (0.37) AOC2TSHRMAOBP2RX7
SCHEMBL11105046 0.78 KMT2A (0.38) AOC2TSHRKDM4EALDH1A1
SCHEMBL3713600 0.76 MEN1 (0.43) AOC2TSHRMAOBKDM4E
SCHEMBL16040115 0.75 KDM4E (0.33) AOC2TSHRKDM4E
SCHEMBL7281438 0.75 AOC2 (0.32) AOC2KDM4E
SCHEMBL31642338 0.75 NPC1 (0.42) AOC2KDM4EALDH1A1
SCHEMBL7287440 0.74 CYP3A4 (0.35) AOC2MAOBALDH1A1
SCHEMBL22833643 0.74 LMNA (0.39) AOC2TSHRMAOBKDM4E
SCHEMBL22648261 0.72 AOC2 (0.35) AOC2MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117897384-A CDK2 inhibitors 缆图药品公司 2024-04-16 CN disclosed
US-20230130822-A1 LOW TOXICITY NMP SUBSTITUTES AND USES THEREOF ADVANCION CORPORATION 2023-04-27 US disclosed
EP-4103550-A2 LOW TOXICITY NMP SUBSTITUTES AND THEIR PREPARATION ANGUS Chemical Company (US) 2022-12-21 EP disclosed
CN-115335360-A Low toxicity NMP substitutes and their preparation 安格斯化学公司 2022-11-11 CN disclosed
CN-109803962-B Modulators of cystic fibrosis transmembrane conductance regulator proteins, and pharmaceutical compositions 弗特克斯药品有限公司 2022-04-29 CN disclosed
WO-2021163348-A2 LOW TOXICITY NMP SUBSTITUTES AND USES THEREOF ANGUS CHEMICAL COMPANY (US) 2021-08-19 WO 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 (1 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-20230130822-A1 LOW TOXICITY NMP SUBSTITUTES AND USES THEREOF NME4, NMBR, NMUR1 AOC2 2578/4885TSHR 3306/4885MAOB 878/4885

“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.