SCHEMBL4378227

SCHEMBL4378227

CN1C2CCC(CO)C1CC2

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.36
LMNA P02545 1/20 0.34
CYP2C9 P11712 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
SCHEMBL5398400 1.00 TDP1 (0.36) TDP1LMNACYP2C9
SCHEMBL14598562 1.00 TDP1 (0.36) TDP1LMNACYP2C9
SCHEMBL4378224 1.00 TDP1 (0.36) TDP1LMNACYP2C9
SCHEMBL7955675 0.84 LMNA (0.43) TDP1LMNACYP2C9
SCHEMBL7955673 0.84 LMNA (0.43) TDP1LMNACYP2C9
SCHEMBL14755887 0.79 SLC6A3 (0.38) TDP1
SCHEMBL4420172 0.79 SLC6A3 (0.38) TDP1
SCHEMBL20692827 0.78 TDP1 (0.32) TDP1
SCHEMBL10607812 0.77 NCF1 (0.33) TDP1
SCHEMBL13894567 0.75 BRD4 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1713800-B1 METHOD FOR PRODUCING A 2-(ETHOXYMETHYL)TROPANE DERIVATIVE NEUROSEARCH AS (DK) 2009-11-18 EP claimed
US-7544802-B2 Process for the preparation of 2-(ethoxymethyl)-tropane derivatives NEUROSEARCH A/S (DK) 2009-06-09 US claimed
US-20050171145-A1 Process for the preparation of 2-(ethoxymethyl)-tropane derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-08-04 US claimed
CN-1910180-B Process for the preparation of 2-(ethoxymethyl)-tropane derivatives NEUROSEARCH AS 2010-05-12 CN disclosed
US-7544802-B2 Process for the preparation of 2-(ethoxymethyl)-tropane derivatives NEUROSEARCH A/S (DK) 2009-06-09 US disclosed
US-7544802-B2 Process for the preparation of 2-(ethoxymethyl)-tropane derivatives NEUROSEARCH A/S (DK) 2009-06-09 US disclosed
US-7250425-B2 8-aza-bicyclo[3.2.1]octane derivatives and their use as monoamine neurotransmitter re-uptake inhibitors NEUROSEARCH A/S (DK) 2007-07-31 US disclosed
CN-1910180-A Process for the preparation of 2-(ethoxymethyl)-tropane derivatives BOEHRINGER INGELHEIM INT (DK) 2007-02-07 CN disclosed
EP-1713800-A2 METHOD FOR PRODUCING A 2-(ETHOXYMETHYL)TROPANE DERIVATIVE NEUROSEARCH A/S (DK) 2006-10-25 EP disclosed
US-20060148847-A1 Novel 8-aza-bicyclo[3.2.1]octane derivatives and their use as monoamine neurotransmitter re-uptake inhibitors ANIONA APS (DK) 2006-07-06 US disclosed
EP-1594874-A1 NOVEL 8-AZA-BICYCLO[3.2.1]OCTANE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2005-11-16 EP disclosed
WO-2005073228-A8 METHOD FOR PRODUCING A 2-(ETHOXYMETHYL)TROPANE DERIVATIVE BOEHRINGER INGELHEIM INT (DE) 2005-10-27 WO disclosed
WO-2005073228-A1 METHOD FOR PRODUCING A 2-(ETHOXYMETHYL)TROPANE DERIVATIVE NEUROSEARCH A/S (DK) 2005-08-11 WO disclosed
US-20050171145-A1 Process for the preparation of 2-(ethoxymethyl)-tropane derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-08-04 US disclosed
US-20050171145-A1 Process for the preparation of 2-(ethoxymethyl)-tropane derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-08-04 US disclosed
WO-2004072075-A1 NOVEL 8-AZA-BICYCLO[3.2.1]OCTANE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2004-08-26 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 (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-20050171145-A1 Process for the preparation of 2-(ethoxymethyl)-tropane derivatives ADRB2, TPM3, TPM4 TDP1 220/4885LMNA 2476/4885CYP2C9 232/4885
US-20060148847-A1 Novel 8-aza-bicyclo[3.2.1]octane derivatives and their use as monoamine neurotransmitter re-uptake inhibitors SLC18A2, SLC18A3, SLC6A2 TDP1 318/4885LMNA 4442/4885CYP2C9 332/4885

“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.