SCHEMBL13285047

SCHEMBL13285047

Bc1c(-c2ccccc2)cccc1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ HPGD P15428 1/20 0.48
▸ BCL2L1 Q07817 1/20 0.48
▸ CYP2A6 P11509 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ BACE1 P56817 1/20 0.43
▸ DPP4 P27487 1/20 0.42
▸ PDCD1 Q15116 1/20 0.41
▸ CD274 Q9NZQ7 1/20 0.41
▸ HNF4A P41235 1/20 0.41
▸ HDAC4 P56524 1/20 0.41
▸ HDAC2 Q92769 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ PRCP P42785 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.39
▸ BCAT2 O15382 1/20 0.39
▸ PLK4 O00444 1/20 0.39
▸ MAPK9 P45984 1/20 0.39

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
SCHEMBL14036933 0.83 ALDH1A1 (0.62) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
Benzene SCHEMBL28035419 0.77 ALDH1A1 (0.61) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL2361430 0.77 ALDH1A1 (0.61) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL21447 0.77 ALDH1A1 (0.61) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL31290744 0.77 ALDH1A1 (0.53) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL13360813 0.77 ALDH1A1 (0.48) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL26838671 0.76 BACE1 (0.39) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL2391683 0.75 ALDH1A1 (0.52) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL22138521 0.74 PTGS2 (0.46) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
Water SCHEMBL27698420 0.74 ALDH1A1 (0.46) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230389407-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-11-30 — — US disclosed
US-8932736-B2 Organic compound and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2015-01-13 — — US disclosed
US-8932736-B2 Organic compound and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2015-01-13 — — US disclosed
EP-2448894-B1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CANON KK (JP) 2014-09-10 — — EP disclosed
EP-2291342-B1 DIBENZO[c,g]FLUORENE COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE USING THE SAME CANON KK (JP) 2014-06-04 — — EP disclosed
US-20120313085-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2012-12-13 — — US disclosed
US-20120313085-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2012-12-13 — — US disclosed
EP-2045231-B1 Binaphthyl compound and organic light emitting element using the same CANON KK (JP) 2010-07-21 — — EP 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-20120313085-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE MRPL38, CRY1, TYR ALDH1A1 459/4885HSD17B10 2784/4885HPGD 4268/4885
US-20230389407-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES SNRPD2, HNRNPDL, SNRPA ALDH1A1 1028/4885HSD17B10 3720/4885HPGD 512/4885

“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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