SCHEMBL5637210

SCHEMBL5637210

C=CCN(C)CCCCOc1ccc2c(c1)CCN2C(=S)NCc1ccco1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.40
MAPK1 P28482 1/20 0.40
LMNA P02545 1/20 0.40
PKM P14618 1/20 0.40
LSS P48449 12/20 0.39
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
MEN1 O00255 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TSHR P16473 1/20 0.37

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
SCHEMBL5637835 0.87 LSS (0.46) LMNALSSPOLBMEN1KMT2A
SCHEMBL5639431 0.85 LSS (0.44) LSSMEN1KMT2A
SCHEMBL5639493 0.84 LSS (0.44) LMNALSSPOLB
SCHEMBL5638141 0.84 LSS (0.48) LMNALSSPOLBMEN1KMT2A
SCHEMBL5971383 0.83 LSS (0.42) LSSALDH1A1HPGDMEN1KMT2A
SCHEMBL5637355 0.83 LSS (0.42) LSSMEN1KMT2A
SCHEMBL5637121 0.82 LSS (0.44) LMNALSSALDH1A1HPGDMEN1
SCHEMBL5971511 0.82 LSS (0.41) LSSMEN1KMT2A
SCHEMBL5971499 0.81 LSS (0.41) LSSMEN1KMT2A
SCHEMBL5637376 0.81 LSS (0.48) LSSMEN1KMT2A

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 USP2 3684/4885MAPK1 1860/4885LMNA 3715/4885

“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.