SCHEMBL25840238

SCHEMBL25840238

CCC(C)=C/C=C(\NC)c1ccccc1C

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 1/20 0.36
FEN1 P39748 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
HPGD P15428 2/20 0.34
KMT2A Q03164 3/20 0.33
ALDH1A1 P00352 3/20 0.32
GAA P10253 2/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
P2RX7 Q99572 1/20 0.32
MEN1 O00255 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL22037150 1.00 ERCC5 (0.36) ERCC5FEN1MAOAMAOBSMN1; SMN2
SCHEMBL23969673 0.78 ATM (0.37) SMN1; SMN2HPGDKMT2AALDH1A1GAA
SCHEMBL16728770 0.77 MAOA (0.38) ERCC5FEN1MAOAMAOBSMN1; SMN2
SCHEMBL23334259 0.76 ERCC5 (0.40) ERCC5FEN1MAOAMAOBSMN1; SMN2
SCHEMBL18790936 0.75 HPGD (0.41) ERCC5FEN1MAOAMAOBSMN1; SMN2
SCHEMBL22111212 0.75 HPGD (0.41) ERCC5FEN1MAOAMAOBSMN1; SMN2
SCHEMBL20416465 0.74 KMT2A (0.36) ERCC5FEN1MAOAMAOBSMN1; SMN2
SCHEMBL24969789 0.73 ERCC5 (0.33) ERCC5FEN1MAOAMAOBSMN1; SMN2
SCHEMBL12986905 0.72 MAOA (0.36) ERCC5FEN1MAOAMAOBSMN1; SMN2
SCHEMBL23334427 0.71 ERCC5 (0.39) ERCC5FEN1SMN1; SMN2HPGDKMT2A

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-20230309396-A1 Host Materials for Electroluminscent Devices UNIVERSAL DISPLAY CORPORATION 2023-09-28 US disclosed
US-11706980-B2 Host materials for electroluminescent devices UNIVERSAL DISPLAY CORPORATION (US) 2023-07-18 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 (2 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-11706980-B2 Host materials for electroluminescent devices CRHR1, CRHR2, CRH ERCC5 757/4885FEN1 2474/4885MAOA 2628/4885
US-20230309396-A1 Host Materials for Electroluminscent Devices CRHR1, CRHR2, CRH ERCC5 778/4885FEN1 2392/4885MAOA 2741/4885

“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.