SCHEMBL25686267

SCHEMBL25686267

CC1(C)c2ccccc2-c2cc(Nc3ccc4ccccc4c3-c3ccccc3-c3ccccc3)ccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
MAPT P10636 1/20 0.35
MAPK14 Q16539 2/20 0.33
ABCG2 Q9UNQ0 3/20 0.32
TSHR P16473 2/20 0.32
CDC25B P30305 2/20 0.32
CYP3A4 P08684 2/20 0.32
HPGD P15428 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TP53 P04637 1/20 0.32
ALOX15 P16050 1/20 0.32
ATM Q13315 1/20 0.32
HSP90AA1 P07900 2/20 0.32
HSP90AB1 P08238 2/20 0.32
CYP1A2 P05177 1/20 0.32
ABCB1 P08183 1/20 0.32
ABCC1 P33527 1/20 0.32
PDK2 Q15119 2/20 0.31
FADS1 O60427 1/20 0.31
CHRNB2 P17787 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
SCHEMBL24432409 0.93 ALDH1A1 (0.37) ALDH1A1MAPTMAPK14ABCG2TSHR
SCHEMBL24432220 0.90 FADS1 (0.35) ALDH1A1MAPTMAPK14TSHRCDC25B
SCHEMBL25686275 0.87 FADS1 (0.34) ALDH1A1MAPTMAPK14TSHRCDC25B
SCHEMBL24432376 0.86 ALDH1A1 (0.35) ALDH1A1MAPTMAPK14CYP3A4HPGD
SCHEMBL24432356 0.86 MAPK14 (0.33) ALDH1A1MAPTMAPK14TSHRHSP90AA1
SCHEMBL23137801 0.86 ALDH1A1 (0.37) ALDH1A1MAPTMAPK14ABCG2TSHR
SCHEMBL25686284 0.84 RAB9A (0.33) ALDH1A1MAPTMAPK14TSHRCDC25B
SCHEMBL24432549 0.83 ALDH1A1 (0.36) ALDH1A1MAPTMAPK14TSHRCDC25B
SCHEMBL24432337 0.82 FADS1 (0.35) ALDH1A1MAPTMAPK14TSHRCDC25B
SCHEMBL23558834 0.82 ALDH1A1 (0.35) ALDH1A1MAPTABCG2TSHRCDC25B

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-20230200219-A1 A compound, an organic electroluminescent device and a display device BEIJING ETERNAL MATERIAL TECHNOLOGY CO., LTD (CN) 2023-06-22 US disclosed
US-20230200219-A1 A compound, an organic electroluminescent device and a display device BEIJING ETERNAL MATERIAL TECHNOLOGY CO., LTD (CN) 2023-06-22 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-20230200219-A1 A compound, an organic electroluminescent device and a display device L1CAM, VDAC2, CD274 ALDH1A1 125/4885MAPT 2949/4885MAPK14 3256/4885

“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.