SCHEMBL6501525

SCHEMBL6501525

Cc1ccccc1NC1=NC(=O)C(CC(=O)N2CCCCCC2)S1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
ALDH1A1 P00352 4/20 0.42
MAPT P10636 3/20 0.42
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
GAA P10253 3/20 0.41
LMNA P02545 2/20 0.40
HSD17B10 Q99714 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
HTT P42858 1/20 0.40
HPGD P15428 1/20 0.40
THRB P10828 1/20 0.39
EPHX2 P34913 1/20 0.39
P2RX7 Q99572 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL6499618 0.86 KMT2A (0.44) TSHRALDH1A1MAPTKDM4EMEN1
SCHEMBL6504768 0.84 CYP2C19 (0.46) TSHRALDH1A1MAPTMEN1KMT2A
SCHEMBL6508360 0.82 ALDH1A1 (0.47) TSHRALDH1A1MAPTKDM4EMEN1
SCHEMBL1383954 0.77 HPGD (0.47) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL31060895 0.77 HPGD (0.47) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL1606462 0.76 KMT2A (0.47) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL6426012 0.74 TSHR (0.50) TSHRALDH1A1MAPTMEN1KMT2A
SCHEMBL6501368 0.73 TSHR (0.49) TSHRALDH1A1KDM4EHSD17B10HTT
SCHEMBL6425891 0.73 TSHR (0.49) TSHRALDH1A1KDM4EHSD17B10HTT
SCHEMBL6429260 0.73 TSHR (0.49) TSHRALDH1A1KDM4EHSD17B10HTT

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-20050239853-A1 New compounds BIOVITRUM AB (SE) 2005-10-27 US claimed
US-20050239853-A1 New compounds BIOVITRUM AB (SE) 2005-10-27 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-20050239853-A1 New compounds HSD11B1, CYP11B1, HSD3B1 TSHR 2078/4885ALDH1A1 67/4885MAPT 3607/4885

“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.