SCHEMBL19768495

SCHEMBL19768495

c1ccc2c(c1)-c1cccc3c(-c4ccc(-c5ccc6ccc7ccc(-c8ccc(-c9ccc%10ccc%11ccccc%11c%10n9)cc8)nc7c6n5)cc4)ccc-2c13

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 2/20 0.43
ENPP3 O14638 1/20 0.43
ALDH1A1 P00352 3/20 0.39
TSHR P16473 2/20 0.39
MAPK1 P28482 2/20 0.39
HSD17B10 Q99714 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
HPGD P15428 2/20 0.39
CASP1 P29466 1/20 0.39
HIF1A Q16665 1/20 0.39
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
PARP1 P09874 2/20 0.38
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 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
SCHEMBL17899310 0.91 PARP1 (0.42) ENPP1ENPP3ALDH1A1TSHRMAPK1
SCHEMBL20250372 0.90 PARP1 (0.41) ENPP1ENPP3ALDH1A1TSHRMAPK1
SCHEMBL20250447 0.90 PARP1 (0.41) ENPP1ENPP3ALDH1A1TSHRMAPK1
SCHEMBL17899291 0.89 LMNA (0.43) ENPP1ENPP3ALDH1A1TSHRMAPK1
SCHEMBL20250388 0.89 PARP1 (0.40) ENPP1ENPP3ALDH1A1TSHRMAPK1
SCHEMBL19768287 0.88 NPC1 (0.47) ENPP1ENPP3ALDH1A1TSHRMAPK1
SCHEMBL19768270 0.87 NPC1 (0.43) ENPP1ENPP3ALDH1A1TSHRMAPK1
SCHEMBL17692152 0.86 ALDH1A1 (0.44) ALDH1A1TSHRMAPK1HSD17B10L3MBTL1
SCHEMBL19768252 0.86 ALDH1A1 (0.41) ENPP1ENPP3ALDH1A1TSHRMAPK1
SCHEMBL19768247 0.86 ALDH1A1 (0.41) ALDH1A1TSHRMAPK1HSD17B10L3MBTL1

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 ENPP1 1393/4885ENPP3 1299/4885ALDH1A1 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.