SCHEMBL19768469

SCHEMBL19768469

c1cc(-c2ccc3c(c2)-c2cccc4cccc-3c24)cc(-c2ccc3ccc4ccc(-c5ccc(-c6ccc7ccc8ccccc8c7n6)cc5)nc4c3n2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.38
▸ TSHR P16473 3/20 0.38
▸ MAPK1 P28482 3/20 0.38
▸ HSD17B10 Q99714 3/20 0.38
▸ HPGD P15428 3/20 0.38
▸ CASP1 P29466 3/20 0.38
▸ HIF1A Q16665 2/20 0.38
▸ CASP7 P55210 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ L3MBTL1 Q9Y468 3/20 0.38
▸ ATM Q13315 2/20 0.38
▸ PARP1 P09874 1/20 0.36
▸ PIM1 P11309 2/20 0.35
▸ PIM2 Q9P1W9 1/20 0.35
▸ ANPEP P15144 1/20 0.35
▸ MAPT P10636 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ APAF1 O14727 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ LMNA P02545 1/20 0.34

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
SCHEMBL19768252 0.96 ALDH1A1 (0.41) ALDH1A1TSHRMAPK1HSD17B10HPGD
SCHEMBL19768380 0.89 ALDH1A1 (0.36) ALDH1A1TSHRMAPK1HSD17B10HPGD
SCHEMBL19777740 0.89 ALDH1A1 (0.33) ALDH1A1TSHRMAPK1HSD17B10HPGD
SCHEMBL19768091 0.88 PARP1 (0.39) ALDH1A1TSHRMAPK1HSD17B10HPGD
SCHEMBL19768323 0.86 MEN1 (0.39) ALDH1A1TSHRMAPK1HSD17B10HPGD
SCHEMBL19768259 0.86 NPC1 (0.40) ALDH1A1TSHRMAPK1HSD17B10HPGD
SCHEMBL19768247 0.86 ALDH1A1 (0.41) ALDH1A1TSHRMAPK1HSD17B10HPGD
SCHEMBL19768395 0.85 ALDH1A1 (0.38) ALDH1A1TSHRMAPK1HSD17B10HPGD
SCHEMBL19768278 0.85 CYP11B1 (0.39) ALDH1A1TSHRMAPK1HSD17B10HPGD
SCHEMBL19768067 0.85 NPC1 (0.44) ALDH1A1TSHRMAPK1HSD17B10HPGD

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-20180019407-A1 PHENANTHROLINE DERIVATIVE, ELECTRONIC DEVICE CONTAINING SAME, LIGHT EMITTING ELEMENT, AND PHOTOELECTRIC CONVERSION ELEMENT TORAY INDUSTRIES, INC (JP) 2018-01-18 — — 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 (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-20180019407-A1 PHENANTHROLINE DERIVATIVE, ELECTRONIC DEVICE CONTAINING SAME, LIGHT EMITTING ELEMENT, AND PHOTOELECTRIC CONVERSION ELEMENT SUN2, PAH, FARS2 ALDH1A1 1297/4885TSHR 4313/4885MAPK1 3270/4885

“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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