SCHEMBL25794054

SCHEMBL25794054

CCCc1c(C)n2ccc3cccc1c32

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ PTGS2 P35354 1/20 0.36
▸ HTR2A P28223 3/20 0.34
▸ HTR2C P28335 2/20 0.34
▸ TSHR P16473 1/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HCRTR1 O43613 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ NCEH1 Q6PIU2 1/20 0.31
▸ HTR1A P08908 1/20 0.31
▸ OXER1 Q8TDS5 1/20 0.30
▸ HSP90AB1 P08238 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
SCHEMBL25794052 0.77 PTGS2 (0.36) ALDH1A1KDM4EHPGDGAAPTGS2
SCHEMBL25794055 0.68 ALKBH5 (0.45) ALDH1A1KDM4EHPGDGAAHTR2A
SCHEMBL21300990 0.64 HTR2A (0.78) ALDH1A1KDM4EHPGDGAAHTR2A
SCHEMBL10335346 0.64 MAPT (0.39) ALDH1A1KDM4EHPGDGAAHTR2A
SCHEMBL19538924 0.63 GPR3 (0.56) ALDH1A1KDM4EHPGDGAATSHR
SCHEMBL31190839 0.62 ALKBH5 (0.41) ALDH1A1KDM4EHPGDGAAPTGS2
SCHEMBL10264882 0.62 CMA1 (0.43) HTR1AOXER1
SCHEMBL7915225 0.61 ALDH1A1 (0.61) ALDH1A1KDM4EHPGDGAAHTR2A
SCHEMBL1696888 0.61 OXER1 (0.40) HTR2AHTR2CHTR1AOXER1
SCHEMBL2127430 0.61 CYP1A2 (0.52) ALDH1A1KDM4EHPGDGAATSHR

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11697653-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2023-07-11 — — 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-11697653-B2 Organic electroluminescent materials and devices L1CAM, SOD1, EPCAM ALDH1A1 380/4885KDM4E 4003/4885HPGD 3289/4885

“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.

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