SCHEMBL6400906

SCHEMBL6400906

C=CCN(C)CC=CCOc1ccc2c(c1)CCCN2S(=O)(=O)Nc1cc(F)ccc1F

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LSS P48449 7/20 0.37
TP53 P04637 5/20 0.37
MAPT P10636 5/20 0.37
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
POLB P06746 1/20 0.33
RORC P51449 2/20 0.33
HRH3 Q9Y5N1 1/20 0.33
FKBP1A P62942 1/20 0.32

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
SCHEMBL6399634 0.94 LSS (0.38) LSSTP53MAPTLMNAMEN1
SCHEMBL6400289 0.89 MAPT (0.41) LSSTP53MAPTLMNAMEN1
SCHEMBL6403927 0.88 MAPT (0.40) LSSTP53MAPTLMNAMEN1
SCHEMBL6403698 0.87 MAPT (0.37) LSSTP53MAPTLMNAPOLB
SCHEMBL6397866 0.86 LSS (0.46) LSSMEN1KMT2AHRH3
SCHEMBL6403997 0.86 LSS (0.46) LSSMEN1KMT2AHRH3
SCHEMBL6400417 0.84 MEN1 (0.43) LSSTP53MAPTLMNAMEN1
SCHEMBL6429091 0.84 MEN1 (0.43) LSSTP53MAPTLMNAMEN1
SCHEMBL5635668 0.84 HRH3 (0.41) LSSTP53MAPTMEN1KMT2A
SCHEMBL6403814 0.83 NLRP3 (0.41) LSSTP53MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050020624-A1 Dihydroindole and tetrahydroquinoline derivatives AEBI JOHANNES (CH) 2005-01-27 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-20050020624-A1 Dihydroindole and tetrahydroquinoline derivatives CYP46A1, LSS, CYP51A1 LSS 2/4885TP53 488/4885MAPT 3562/4885

“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.