SCHEMBL13487128

SCHEMBL13487128

CN1c2ccccc2N(c2c3ccccc3c(-c3cccc4c3-c3ccccc3C4(C)C)c3cc(-c4ccccc4)ccc23)c2ccccc21

nearest known ligand 0.32

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TYMS P04818 1/20 0.32
MEN1 O00255 2/20 0.31
MAPT P10636 2/20 0.31
KMT2A Q03164 2/20 0.31
GAA P10253 1/20 0.31
TP53 P04637 1/20 0.30
RARA P10276 1/20 0.30
RARB P10826 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
RECQL P46063 1/20 0.30
BLM P54132 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
BRD4 O60885 1/20 0.30

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
SCHEMBL13487391 0.94 PDK2 (0.31) MEN1MAPTKMT2AGAA
SCHEMBL13487125 0.94 TYMS (0.33) TYMSMEN1MAPTKMT2AGAA
SCHEMBL13487302 0.92 AKT1 (0.38) MEN1MAPTKMT2AGAAMAPK1
SCHEMBL13487197 0.91 MEN1 (0.35) MEN1MAPTKMT2AGAAMAPK1
SCHEMBL13487127 0.90 TYMS (0.31) TYMS
SCHEMBL13487129 0.90 TYMS (0.31) TYMSKMT2ATSHR
SCHEMBL13487132 0.90 HSD17B3 (0.37) TYMSKMT2ATSHRSMN1; SMN2
SCHEMBL13487131 0.90 TYMS (0.31) TYMS
SCHEMBL13487130 0.89 TYMS (0.31) TYMS
SCHEMBL13487126 0.89 TYMS (0.31) TYMS

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-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-25 US disclosed
US-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-25 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-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, OCIAD2, ORMDL3 TYMS 1763/4885MEN1 3017/4885MAPT 2219/4885

“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.