SCHEMBL6539221

SCHEMBL6539221

CCOC(=O)CCC(C(=O)c1ccccc1)c1ccc(=O)n(C(C)C)n1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
KDM4E B2RXH2 4/20 0.46
HPGD P15428 3/20 0.46
GLA P06280 1/20 0.46
POLB P06746 1/20 0.40
HTT P42858 1/20 0.40
TSHR P16473 2/20 0.38
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
PTPN1 P18031 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL6538330 0.90 POLB (0.39) ALDH1A1KDM4EHPGDGLAPOLB
SCHEMBL9258457 0.75 LMNA (0.50) ALDH1A1KDM4EHTTLMNAL3MBTL1
SCHEMBL29029672 0.73 SMN1; SMN2 (0.48) ALDH1A1POLBMAPTL3MBTL1MEN1
SCHEMBL6133369 0.73 LMNA (0.39) ALDH1A1KDM4EHPGDGLAPOLB
SCHEMBL5150644 0.73 POLB (0.40) ALDH1A1KDM4EHPGDGLAPOLB
SCHEMBL5388545 0.73 LMNA (0.39) ALDH1A1KDM4EHPGDGLAPOLB
SCHEMBL6923211 0.70 ALDH1A1 (0.38) ALDH1A1KDM4EHPGDGLAPOLB
SCHEMBL7708924 0.70 SMN1; SMN2 (0.44) ALDH1A1HTTMAPTL3MBTL1MEN1
SCHEMBL29029675 0.70 SMN1; SMN2 (0.44) ALDH1A1MAPTL3MBTL1MEN1KMT2A
SCHEMBL27496358 0.70 SMN1; SMN2 (0.47) ALDH1A1POLBMAPTL3MBTL1MEN1

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-20040067955-A1 Pyridazinone compound and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2004-04-08 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-20040067955-A1 Pyridazinone compound and pharmaceutical use thereof ADORA1, ADORA2A, P2RX5 ALDH1A1 1399/4885KDM4E 3052/4885HPGD 322/4885

“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.