SCHEMBL4384965

SCHEMBL4384965

COC(=O)Cc1cc(O)cc(O)c1-c1ccc(CN2CCN(C)CC2)o1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ALK Q9UM73 1/20 0.41
ABCB1 P08183 1/20 0.38
KDM4E B2RXH2 5/20 0.37
GLA P06280 3/20 0.37
GAA P10253 2/20 0.37
ERAP1 Q9NZ08 2/20 0.36
ATM Q13315 1/20 0.36
HPGD P15428 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 1/20 0.35
POLB P06746 2/20 0.35

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
SCHEMBL4384657 0.90 HTT (0.43) ALDH1A1SMN1; SMN2KMT2AMEN1NPSR1
SCHEMBL4383921 0.82 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL4395260 0.81 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL4388212 0.80 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2KMT2AMEN1NPSR1
SCHEMBL4384303 0.79 SMN1; SMN2 (0.39) ALDH1A1SMN1; SMN2KMT2AMEN1NPSR1
SCHEMBL4386133 0.78 LMNA (0.52) ALDH1A1SMN1; SMN2KMT2AMEN1POLB
SCHEMBL4389553 0.78 EGFR (0.40) ALDH1A1SMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL4389601 0.78 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL4392305 0.77 KDM4E (0.40) ALDH1A1KMT2AMEN1KDM4EGLA
SCHEMBL4385587 0.75 NPSR1 (0.37) ALDH1A1KMT2AMEN1NPSR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538241-B2 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-05-26 US disclosed
US-20070155813-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-05 US disclosed
EP-1704856-A1 HSP90 FAMILY PROTEIN INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-09-27 EP 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-20070155813-A1 Hsp90 family protein inhibitors HSP90AB1, HEATR1, HSP90AB2P ALDH1A1 3520/4885SMN1; SMN2 4471/4885KMT2A 3994/4885

“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.