SCHEMBL5947418

SCHEMBL5947418

CCCOc1cccc(CNCCc2ccc(Cl)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 8/20 0.58
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ HTT P42858 2/20 0.53
▸ KDM4E B2RXH2 2/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ CYP2D6 P10635 3/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ TAAR1 Q96RJ0 1/20 0.47

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
SCHEMBL5170863 0.90 BCHE (0.55) BCHECYP2D6KMT2ACYP1A2CYP3A4
SCHEMBL12228161 0.89 BCHE (0.72) BCHEKDM4ELMNACYP2D6
SCHEMBL5947308 0.88 BCHE (0.59) BCHESMN1; SMN2KDM4ECYP2D6MAPK1
SCHEMBL5947438 0.88 BCHE (0.53) BCHECYP2D6CYP1A2CYP2C19
SCHEMBL5947204 0.87 BCHE (0.59) BCHESMN1; SMN2KDM4ECYP2D6
SCHEMBL5947391 0.87 BCHE (0.73) BCHESMN1; SMN2HTTKDM4EALDH1A1
SCHEMBL5947825 0.87 BCHE (0.73) BCHESMN1; SMN2KDM4ECYP2D6
SCHEMBL5947471 0.87 BCHE (0.58) BCHESMN1; SMN2KDM4ECYP2D6CYP1A2
SCHEMBL5947161 0.87 SMN1; SMN2 (0.61) BCHESMN1; SMN2KDM4EALDH1A1CYP2D6
SCHEMBL5947378 0.86 BCHE (0.65) BCHESMN1; SMN2HTTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060009511-A9 N-(2-arylethyl) benzylamines as antagonists of the 5-ht6 receptor CHEN ZHAOGEN 2006-01-12 — — US claimed
CN-1610547-A N-(2-arylethyl)benzylamines as antagonists of the 5-HT6 receptor LILLY CO ELI (US) 2005-04-27 — — CN claimed
EP-1379239-A2 N-(2-ARYLETHYL) BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR ELI LILLY AND COMPANY (US) 2004-01-14 — — EP claimed
WO-2002078693-A2 N-(2-ARYLETHYL)BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR ELI LILLY AND COMPANY (US) 2002-10-10 — — WO claimed

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-20060009511-A9 N-(2-arylethyl) benzylamines as antagonists of the 5-ht6 receptor HTR6, HTR2C, HTR1B BCHE 763/4885SMN1; SMN2 3792/4885HTT 465/4885

“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.

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