SCHEMBL5635668

SCHEMBL5635668

C=CCN(C)CC=CCOc1ccc2c(c1)CCCN2S(=O)(=O)Nc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.41
LSS P48449 6/20 0.40
TP53 P04637 2/20 0.38
MAPT P10636 2/20 0.38
ADRB2 P07550 2/20 0.35
ADRB1 P08588 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
GAA P10253 1/20 0.34
RORC P51449 1/20 0.34
TSHR P16473 1/20 0.34
MCOLN3 Q8TDD5 1/20 0.34
ADRB3 P13945 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
SCHEMBL5638296 0.92 MAPT (0.47) LSSTP53MAPT
SCHEMBL6403814 0.92 NLRP3 (0.41) LSSTP53MAPTMEN1KMT2A
SCHEMBL6400289 0.91 MAPT (0.41) HRH3LSSTP53MAPTMEN1
SCHEMBL6400417 0.91 MEN1 (0.43) HRH3LSSTP53MAPTMEN1
SCHEMBL6430242 0.91 LSS (0.49) HRH3LSSTP53MAPTMEN1
SCHEMBL6398603 0.91 LSS (0.49) HRH3LSSTP53MAPTMEN1
SCHEMBL6429091 0.91 MEN1 (0.43) HRH3LSSTP53MAPTMEN1
SCHEMBL6403698 0.91 MAPT (0.37) HRH3LSSTP53MAPTGAA
SCHEMBL6406579 0.91 LSS (0.40) HRH3LSSTP53MAPTMEN1
SCHEMBL6404825 0.89 MAPT (0.40) LSSTP53MAPTRORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7102007-B2 Dihydroindole and tetrahydroquinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2006-09-05 US disclosed
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 HRH3 1065/4885LSS 2/4885TP53 488/4885

“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.