SCHEMBL5464313

SCHEMBL5464313

CCN(CC)CC.CN1C(=CC2=C(O)C(=O)C2=C(C#N)C#N)C(C)(C)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.47
MEN1 O00255 10/20 0.47
KMT2A Q03164 10/20 0.47
HTT P42858 5/20 0.47
CRHBP P24387 3/20 0.47
CRHR2 Q13324 3/20 0.47
KEAP1 Q14145 1/20 0.47
NFE2L2 Q16236 1/20 0.47
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
RAB9A P51151 1/20 0.44
KDM4E B2RXH2 8/20 0.41
LMNA P02545 5/20 0.41
MAPK1 P28482 5/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
TSHR P16473 2/20 0.40

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
SCHEMBL14117448 0.93 MEN1 (0.53) MAPTMEN1KMT2AHTTCRHBP
SCHEMBL5003440 0.85 FOLH1 (0.40) MAPTMEN1KMT2AHTTCRHBP
SCHEMBL17627867 0.84 LMNA (0.34) MAPTMEN1KMT2AHTTCRHBP
SCHEMBL17627870 0.78 ALDH1A1 (0.39) MAPTMEN1KMT2AHTTCRHBP
SCHEMBL17627868 0.78 ALDH1A1 (0.39) MAPTMEN1KMT2AHTTCRHBP
SCHEMBL13569247 0.77 LMNA (0.54) MAPTMEN1KMT2AHTTCRHBP
SCHEMBL24487199 0.76 MEN1 (0.42) MAPTMEN1KMT2AHTTCRHBP
SCHEMBL14117469 0.75 MEN1 (0.34) MAPTMEN1KMT2AHTTCRHBP
SCHEMBL5517797 0.74 MEN1 (0.43) MAPTMEN1KMT2AHTTCRHBP
SCHEMBL14199092 0.74 MEN1 (0.44) MAPTMEN1KMT2AHTTCRHBP

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-9841428-B2 Viscosity-sensitive dyes and method SETA BIOMEDICALS, LLC (US) 2017-12-12 US disclosed
US-20160091495-A1 VISCOSITY-SENSITIVE DYES AND METHOD SETA BIOMEDICALS, LLC 2016-03-31 US disclosed
US-20070281363-A1 Reporter molecules based on squaric, croconic, and/or rhodizonic acid; photoluminescence Terpetschnig, Ewald (US) 2007-12-06 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-20070281363-A1 Reporter molecules based on squaric, croconic, and/or rhodizonic acid; photoluminescence SPR, SRRT, SQLE MAPT 3790/4885MEN1 2672/4885KMT2A 3474/4885

“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.