SCHEMBL19768161

SCHEMBL19768161

c1ccc2c(-c3ccc(-c4ccc(-c5ccc6ccc7ccc(-c8cccc9ccccc89)nc7c6n5)cc4)nn3)cccc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP3 O14638 1/20 0.42
▸ ENPP1 P22413 1/20 0.42
▸ ALDH1A1 P00352 4/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ HPGD P15428 3/20 0.41
▸ PARP1 P09874 1/20 0.40
▸ AR P10275 2/20 0.38
▸ RAB9A P51151 2/20 0.37
▸ ATM Q13315 2/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ PIM1 P11309 2/20 0.36
▸ TUBB4A P04350 1/20 0.36
▸ TUBB P07437 1/20 0.36
▸ TUBA3C P0DPH7 1/20 0.36
▸ TUBA1B P68363 1/20 0.36
▸ TUBA4A P68366 1/20 0.36
▸ TUBB4B P68371 1/20 0.36
▸ TUBB3 Q13509 1/20 0.36

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
SCHEMBL10032245 0.94 ENPP3 (0.46) ENPP3ENPP1ALDH1A1KDM4EHPGD
SCHEMBL10032339 0.92 ENPP3 (0.45) ENPP3ENPP1ALDH1A1KDM4EHPGD
SCHEMBL10032442 0.90 ENPP1 (0.48) ENPP3ENPP1ALDH1A1KDM4EHPGD
SCHEMBL19768245 0.90 ENPP3 (0.44) ENPP3ENPP1ALDH1A1KDM4EHPGD
SCHEMBL10032343 0.89 ENPP1 (0.47) ENPP3ENPP1ALDH1A1KDM4EHPGD
SCHEMBL10032267 0.87 ALDH1A1 (0.50) ENPP3ENPP1ALDH1A1KDM4EHPGD
SCHEMBL30414026 0.87 ALDH1A1 (0.50) ENPP3ENPP1ALDH1A1KDM4EHPGD
SCHEMBL14900756 0.87 ALDH1A1 (0.50) ENPP3ENPP1ALDH1A1KDM4EHPGD
SCHEMBL10032382 0.86 CA12 (0.43) ENPP3ENPP1ALDH1A1KDM4EHPGD
SCHEMBL20250389 0.86 ENPP1 (0.48) ENPP3ENPP1ALDH1A1KDM4EHPGD

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-20180019407-A1 PHENANTHROLINE DERIVATIVE, ELECTRONIC DEVICE CONTAINING SAME, LIGHT EMITTING ELEMENT, AND PHOTOELECTRIC CONVERSION ELEMENT TORAY INDUSTRIES, INC (JP) 2018-01-18 — — US disclosed
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 ENPP3 1299/4885ENPP1 1393/4885ALDH1A1 1297/4885

“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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