SCHEMBL31575751

SCHEMBL31575751

CCC(N)(CN)C1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
SIGMAR1 Q99720 1/20 0.31
EPHX1 P07099 1/20 0.30
SHBG P04278 1/20 0.30

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
SCHEMBL1030996 0.88 CYP1A2 (0.37) CYP1A2SIGMAR1SHBG
SCHEMBL13640032 0.85 CYP1A2 (0.33) CYP1A2
SCHEMBL3429559 0.75
SCHEMBL28773021 0.74 ALDH1A1 (0.33) CYP1A2EPHX1
SCHEMBL2067553 0.73 CYP1A2 (0.37) CYP1A2SIGMAR1SHBG
SCHEMBL5083323 0.73 CYP1A2 (0.37) CYP1A2SIGMAR1SHBG
SCHEMBL16935658 0.71 SIGMAR1 (0.33) CYP1A2SIGMAR1EPHX1
SCHEMBL17976970 0.71 CYP1A2 (0.36) CYP1A2SHBG
SCHEMBL1900863 0.70 SIGMAR1 (0.36) SIGMAR1EPHX1
SCHEMBL20841523 0.70 MEN1 (0.43) CYP1A2SIGMAR1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4556101-A1 GAS REMOVAL METHOD Evonik Operations GmbH (DE) 2025-05-21 EP disclosed
CN-120019859-A Method for removing gas 赢创运营有限公司 2025-05-20 CN disclosed