SCHEMBL4828355

SCHEMBL4828355

O=C(C=C(CN1CCCCC1)c1cc2ccccc2o1)NCCOc1ccc(C(=O)NO)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.50
TSHR P16473 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
KDM4E B2RXH2 2/20 0.44
HDAC3 O15379 3/20 0.44
HDAC1 Q13547 3/20 0.44
HDAC2 Q92769 3/20 0.44
HDAC10 Q969S8 3/20 0.44
HDAC8 Q9BY41 3/20 0.44
HDAC6 Q9UBN7 3/20 0.44
HDAC4 P56524 2/20 0.44
HDAC7 Q8WUI4 2/20 0.44
HDAC11 Q96DB2 2/20 0.44
HDAC9 Q9UKV0 2/20 0.44
HDAC5 Q9UQL6 2/20 0.44
NCOR2 Q9Y618 1/20 0.44
LMNA P02545 3/20 0.42
DRD2 P14416 1/20 0.42
DRD3 P35462 1/20 0.42
MEN1 O00255 1/20 0.41

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
SCHEMBL4837020 0.99 HPGD (0.51) HPGDTSHRSMN1; SMN2KDM4EHDAC3
SCHEMBL14181486 0.97 HPGD (0.51) HPGDTSHRSMN1; SMN2KDM4EHDAC3
SCHEMBL4867445 0.97 HPGD (0.51) HPGDTSHRSMN1; SMN2KDM4EHDAC3
Hydrochloric Acid SCHEMBL4836766 0.97 HPGD (0.50) HPGDTSHRSMN1; SMN2KDM4EHDAC3
SCHEMBL4838110 0.93 SMN1; SMN2 (0.49) HPGDTSHRSMN1; SMN2KDM4EHDAC3
SCHEMBL14181485 0.89 HPGD (0.47) HPGDTSHRSMN1; SMN2KDM4EHDAC3
SCHEMBL4839889 0.89 HPGD (0.47) HPGDTSHRSMN1; SMN2KDM4EHDAC3
Hydrochloric Acid SCHEMBL4834878 0.88 KDM4E (0.47) HPGDTSHRSMN1; SMN2KDM4EHDAC3
SCHEMBL4833967 0.88 TSHR (0.48) HPGDTSHRSMN1; SMN2KDM4ELMNA
SCHEMBL9995335 0.83 HDAC3 (0.54) HPGDTSHRSMN1; SMN2HDAC3HDAC1

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-7368476-B2 Hydroxamates as therapeutic agents PHARMACYCLICS, INC. (US) 2008-05-06 US disclosed
US-20050227976-A1 Novel hydroxamates as therapeutic agents AXYS PHARMACEUTICALS, INC. (US) 2005-10-13 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-20050227976-A1 Novel hydroxamates as therapeutic agents HDAC1, HDAC5, HDAC10 HPGD 116/4885TSHR 3505/4885SMN1; SMN2 2607/4885

“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.