SCHEMBL5947686

SCHEMBL5947686

Fc1ccccc1Oc1cccc(CNCCc2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.60
▸ MEN1 O00255 2/20 0.60
▸ KMT2A Q03164 2/20 0.60
▸ TDP1 Q9NUW8 2/20 0.53
▸ ROCK1 Q13464 1/20 0.47
▸ BCHE P06276 4/20 0.46
▸ SCN8A Q9UQD0 1/20 0.46
▸ CARM1 Q86X55 1/20 0.45
▸ PRMT6 Q96LA8 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ MAPK14 Q16539 1/20 0.44
▸ TAAR1 Q96RJ0 1/20 0.44
▸ LTA4H P09960 1/20 0.43
▸ EPHX2 P34913 1/20 0.43
▸ FDFT1 P37268 2/20 0.43
▸ HTR6 P50406 2/20 0.42
▸ PARP1 P09874 1/20 0.41

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
SCHEMBL5947704 0.87 KDM4E (0.69) KDM4EMEN1KMT2ATDP1ROCK1
SCHEMBL5947560 0.87 KDM4E (0.58) KDM4EMEN1KMT2ATDP1ROCK1
SCHEMBL5947469 0.86 KDM4E (0.62) KDM4EMEN1KMT2ATDP1ROCK1
SCHEMBL5947369 0.85 KDM4E (0.64) KDM4EMEN1KMT2ATDP1ROCK1
SCHEMBL5947093 0.84 CYP1A2 (0.60) KDM4EMEN1KMT2ATDP1BCHE
SCHEMBL5947565 0.83 KDM4E (0.61) KDM4EMEN1KMT2ATDP1ROCK1
SCHEMBL5947251 0.81 KDM4E (0.61) KDM4EMEN1KMT2ATDP1ROCK1
SCHEMBL5947464 0.80 BCHE (0.74) KDM4EMEN1KMT2ATDP1ROCK1
SCHEMBL5947177 0.80 KDM4E (0.58) KDM4EMEN1KMT2ATDP1ROCK1
SCHEMBL5947203 0.80 KDM4E (0.66) KDM4EMEN1KMT2ATDP1ROCK1

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 KDM4E 1970/4885MEN1 1889/4885KMT2A 1269/4885

“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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