SCHEMBL3830478

SCHEMBL3830478

NC(c1ccc(Cl)cc1)C1(NC(=O)O)CCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.39
CYP2C9 P11712 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C19 P33261 2/20 0.38
BRD4 O60885 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC5 Q9UQL6 1/20 0.37
SLC6A4 P31645 4/20 0.36
GABBR2 O75899 3/20 0.36
GABBR1 Q9UBS5 3/20 0.36
SLC6A3 Q01959 3/20 0.36
LMNA P02545 2/20 0.36
CYP3A4 P08684 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
NFKB1 P19838 1/20 0.36
DRD3 P35462 1/20 0.36
BLM P54132 1/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL13567856 0.80 DRD2 (0.41) CYP2C9MEN1KMT2ACYP2D6CYP2C19
SCHEMBL27752749 0.73 BRD4 (0.40) HDAC4CYP2C9MEN1KMT2ACYP2D6
SCHEMBL2577734 0.73 BRD4 (0.37) HDAC4CYP2C9MEN1KMT2ACYP2D6
SCHEMBL15601047 0.72 CYP2C9 (0.42) HDAC4CYP2C9MEN1KMT2ACYP2D6
SCHEMBL3834022 0.70 SLC6A4 (0.44) BRD4SLC6A4SLC6A3LMNACYP3A4
SCHEMBL16161986 0.66 HDAC4 (0.47) HDAC4
SCHEMBL19744901 0.65 ALDH1A1 (0.30) SMN1; SMN2
SCHEMBL15258671 0.65 HDAC3 (0.47) HDAC4KMT2ATSHRCNR1
SCHEMBL27773603 0.65 PPARG (0.39) MEN1KMT2ASLC6A4LMNATSHR
SCHEMBL15601041 0.65 MEN1 (0.49) CYP2C9MEN1KMT2ACYP2D6CYP2C19

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-20090312310-A1 Imidazothiazole derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-12-17 US disclosed
EP-2103619-A1 IMIDAZOTHIAZOLE DERIVATIVES Daiichi Sankyo Company, Limited (JP) 2009-09-23 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-20090312310-A1 Imidazothiazole derivatives TP53, MDM2, TP53BP1 HDAC4 766/4885CYP2C9 3504/4885MEN1 2718/4885

“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.