SCHEMBL17880358

SCHEMBL17880358

Cc1ccccc1B(c1ccccc1C)c1ccc2ccc3c(Br)ccc4ccc1c2c43

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP1A2 P05177 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
SCHEMBL17880360 0.85 ALDH1A1 (0.53) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL17880355 0.84 ALDH1A1 (0.41) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL17880354 0.76 ALDH1A1 (0.31) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL17880367 0.76 CYP1A2 (0.35) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL28132984 0.73 ALDH1A1 (0.55) ALDH1A1CYP3A4HPGDTSHRHSD17B10
Toluene SCHEMBL28132983 0.72 TSHR (0.46) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL15497853 0.72 ALDH1A1 (0.61) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL25639338 0.71 HSD17B10 (0.52) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL25639351 0.71 HSD17B10 (0.52) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL1062422 0.71 CYP1A2 (0.39) ALDH1A1CYP3A4HPGDTSHRHSD17B10

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-11793063-B2 Condensed-cyclic compound and organic light emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2023-10-17 US disclosed
US-11793063-B2 Condensed-cyclic compound and organic light emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2023-10-17 US disclosed
US-20160190450-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 US disclosed
US-20160190450-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 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-11793063-B2 Condensed-cyclic compound and organic light emitting device including the same CRY1, CRY2, CCNE2 ALDH1A1 518/4885CYP3A4 1257/4885HPGD 1827/4885
US-20160190450-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 ALDH1A1 518/4885CYP3A4 1257/4885HPGD 1827/4885

“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.