SCHEMBL5517797

SCHEMBL5517797

CCN(CC)CC.CN1C(=Cc2c(O)c(=O)c2=NC#N)C(C)(C)c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.43
KMT2A Q03164 8/20 0.43
HTT P42858 8/20 0.43
MAPT P10636 8/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
KDM4E B2RXH2 7/20 0.41
MAPK1 P28482 4/20 0.41
HSD17B10 Q99714 2/20 0.41
ALOX15 P16050 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 6/20 0.40
LMNA P02545 6/20 0.40
POLB P06746 1/20 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
SCHEMBL14093791 0.93 MAPT (0.48) MEN1KMT2AHTTMAPTCRHBP
SCHEMBL14453270 0.80 MAPT (0.52) MEN1KMT2AHTTMAPTCRHBP
SCHEMBL5522293 0.80 MAPT (0.52) MEN1KMT2AHTTMAPTCRHBP
SCHEMBL3853022 0.76 LMNA (0.55) MEN1KMT2AHTTMAPTCRHBP
SCHEMBL3853014 0.76 LMNA (0.55) MEN1KMT2AHTTMAPTCRHBP
SCHEMBL5464313 0.74 MAPT (0.47) MEN1KMT2AHTTMAPTCRHBP
SCHEMBL7155651 0.71 MAPT (0.37) MEN1KMT2AHTTMAPTCRHBP
SCHEMBL14453269 0.71 MAPT (0.46) MEN1KMT2AHTTMAPTCRHBP
SCHEMBL5003871 0.70 FOLH1 (0.39) MEN1KMT2AHTTMAPTKDM4E
SCHEMBL5517790 0.69 PDK2 (0.33) GAA

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 4 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-7250517-B2 Luminescent compounds Terpetschnig, Ewald A. (US) 2007-07-31 US disclosed
US-20040166515-A1 Luminescent compounds TERPETSCHNIG, EWALD A. 2004-08-26 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-20040166515-A1 Luminescent compounds RORC, NR2E3, RORB MEN1 3748/4885KMT2A 4136/4885HTT 3369/4885

“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.