SCHEMBL6427508

SCHEMBL6427508

O=C1N=C(NC2CCCCCCC2)SC1CCNC(=O)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
HTT P42858 1/20 0.40
GAA P10253 1/20 0.38
HSD11B1 P28845 3/20 0.38
CCR2 P41597 2/20 0.37
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
ALDH1A1 P00352 3/20 0.36
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.36
CYP17A1 P05093 1/20 0.36
CYP19A1 P11511 1/20 0.36
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.34
HTR1A P08908 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 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
SCHEMBL10249415 0.81 EPHX1 (0.34) KDM4EHTTMEN1KMT2AALDH1A1
SCHEMBL6503922 0.80 EPHX1 (0.51) KDM4EALDH1A1TP53TSHR
SCHEMBL6504671 0.80 EPHX1 (0.51) KDM4EALDH1A1TP53TSHR
SCHEMBL6427758 0.80 NAAA (0.41) KDM4EMEN1KMT2AALDH1A1TSHR
SCHEMBL6390166 0.80 NAAA (0.38) KDM4EMEN1KMT2AALDH1A1TSHR
SCHEMBL6502409 0.78 EPHX1 (0.37) MEN1KMT2AALDH1A1HPGDHTR1A
SCHEMBL6499847 0.76 RAB9A (0.36) GAAKMT2AALDH1A1TP53TSHR
SCHEMBL1605232 0.75 SLC29A1 (0.34) KDM4EGAAPOLB
Trifluoroacetic Acid SCHEMBL1605821 0.74 EPHX1 (0.32) HTTMEN1KMT2AALDH1A1
SCHEMBL6510198 0.74 CXCR4 (0.44) KDM4EMEN1KMT2AALDH1A1TSHR

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-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
WO-2005075471-A2 THIAZOL-COMPOUNDS AS 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS BIOVITRUM AB (SE) 2005-08-18 WO 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 KDM4E 2824/4885HTT 3969/4885GAA 522/4885

“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.