SCHEMBL19768498

SCHEMBL19768498

c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-c2ccc3ccc4ccc(-c5ccc(-c6ccc7ccc8ccccc8c7n6)cc5)nc4c3n2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.41
▸ HPRT1 P00492 3/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP1A1 P04798 1/20 0.36
▸ CYP1B1 Q16678 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ PIM1 P11309 1/20 0.34
▸ PIM2 Q9P1W9 1/20 0.34
▸ AR P10275 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ CYP17A1 P05093 1/20 0.34
▸ CYP19A1 P11511 1/20 0.34
▸ CYP11B1 P15538 1/20 0.34
▸ CYP11B2 P19099 1/20 0.34
▸ CCR4 P51679 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
SCHEMBL19768249 0.97 PARP1 (0.40) PARP1HPRT1CYP1A2CYP2D6CYP1A1
SCHEMBL17899306 0.92 PARP1 (0.44) PARP1CYP1A1CYP1B1MEN1RAB9A
SCHEMBL21103664 0.91 PARP1 (0.43) PARP1CYP1A1CYP1B1MEN1RAB9A
SCHEMBL17231470 0.91 HPRT1 (0.45) PARP1HPRT1CYP1A2CYP1A1CYP1B1
SCHEMBL19768467 0.88 CYP11B1 (0.46) PARP1CYP1A2CYP1A1CYP1B1RAB9A
SCHEMBL20250429 0.88 PARP1 (0.42) PARP1CYP1A1CYP1B1MEN1RAB9A
SCHEMBL21674508 0.88 PARP1 (0.45) PARP1CYP1A1CYP1B1MEN1RAB9A
SCHEMBL10032508 0.88 PARP1 (0.45) PARP1CYP1A1CYP1B1MEN1RAB9A
SCHEMBL26120274 0.88 PARP1 (0.44) PARP1CYP1A1CYP1B1MEN1RAB9A
SCHEMBL20208243 0.87 PARP1 (0.46) PARP1HPRT1CYP1B1MEN1RAB9A

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 PARP1 1407/4885HPRT1 69/4885CYP1A2 297/4885

“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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