SCHEMBL4378224

SCHEMBL4378224

CN1[C@@H]2CCC(CO)[C@H]1CC2

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
SCHEMBL4378227 1.00 TDP1 (0.36) TDP1LMNACYP2C9
SCHEMBL5398400 1.00 TDP1 (0.36) TDP1LMNACYP2C9
SCHEMBL14598562 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 14 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
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
CN-1910180-A Process for the preparation of 2-(ethoxymethyl)-tropane derivatives BOEHRINGER INGELHEIM INT (DK) 2007-02-07 CN 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
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

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-20050171145-A1 Process for the preparation of 2-(ethoxymethyl)-tropane derivatives ADRB2, TPM3, TPM4 TDP1 220/4885LMNA 2476/4885CYP2C9 232/4885

“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.