SCHEMBL19768203

SCHEMBL19768203

c1ccc2c(-c3ccc4ccc5ccc(-c6ccc(-c7nc8ccccc8o7)cc6)nc5c4n3)cccc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.49
▸ NPC1 O15118 6/20 0.49
▸ HSD17B10 Q99714 6/20 0.49
▸ HPGD P15428 6/20 0.49
▸ RAB9A P51151 5/20 0.49
▸ MAPT P10636 5/20 0.49
▸ MEN1 O00255 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ TP53 P04637 3/20 0.49
▸ HCRTR1 O43613 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ KDM4E B2RXH2 4/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ ATM Q13315 1/20 0.48
▸ ESR1 P03372 1/20 0.44
▸ ESR2 Q92731 1/20 0.44
▸ MMP2 P08253 1/20 0.43
▸ MMP9 P14780 1/20 0.43
▸ MMP8 P22894 1/20 0.43
▸ MMP13 P45452 1/20 0.43

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
SCHEMBL18100865 0.91 ALDH1A1 (0.45) ALDH1A1NPC1HSD17B10HPGDRAB9A
SCHEMBL19768211 0.90 NPC1 (0.45) ALDH1A1NPC1HSD17B10HPGDRAB9A
SCHEMBL19768432 0.89 TP53 (0.46) ALDH1A1NPC1HSD17B10HPGDRAB9A
SCHEMBL19768210 0.87 NPC1 (0.46) ALDH1A1NPC1HSD17B10HPGDRAB9A
SCHEMBL28681367 0.83 NPC1 (0.59) ALDH1A1NPC1HSD17B10HPGDRAB9A
SCHEMBL10032245 0.83 ENPP3 (0.46) ALDH1A1NPC1HSD17B10HPGDRAB9A
SCHEMBL19768434 0.82 NPC1 (0.46) ALDH1A1NPC1HSD17B10HPGDRAB9A
SCHEMBL13643034 0.82 NPC1 (0.48) ALDH1A1NPC1HSD17B10HPGDRAB9A
SCHEMBL10032339 0.81 ENPP3 (0.45) ALDH1A1NPC1HSD17B10HPGDRAB9A
SCHEMBL19768430 0.81 NPC1 (0.42) ALDH1A1NPC1HSD17B10HPGDRAB9A

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 1297/4885NPC1 4176/4885HSD17B10 1911/4885

“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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