SCHEMBL17915344

SCHEMBL17915344

c1cc(-c2cccc(-c3nc4ccccc4c4c5ccccc5c5ccccc5c34)c2)cc(-c2cc(-c3ccncc3)nc(-c3ccncc3)c2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.45
▸ KDM4E B2RXH2 4/20 0.45
▸ HPGD P15428 3/20 0.45
▸ MAPT P10636 2/20 0.45
▸ DHODH Q02127 1/20 0.43
▸ LMNA P02545 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ CYP2C9 P11712 4/20 0.40
▸ CYP3A4 P08684 3/20 0.40
▸ ACHE P22303 1/20 0.39
▸ CYP19A1 P11511 1/20 0.39
▸ POLB P06746 2/20 0.38
▸ RAD52 P43351 1/20 0.38
▸ GSK3B P49841 1/20 0.37
▸ CDC7 O00311 1/20 0.37
▸ NPC1 O15118 1/20 0.37

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
SCHEMBL17915297 1.00 ALDH1A1 (0.45) ALDH1A1KDM4EHPGDMAPTDHODH
SCHEMBL17914788 0.97 DHODH (0.47) ALDH1A1KDM4EHPGDMAPTDHODH
SCHEMBL17914793 0.95 DHODH (0.47) ALDH1A1KDM4EHPGDMAPTDHODH
SCHEMBL17915178 0.95 DHODH (0.47) ALDH1A1KDM4EHPGDMAPTDHODH
SCHEMBL17914785 0.93 ACHE (0.44) KDM4EHPGDDHODHLMNAMEN1
SCHEMBL17914764 0.92 NOTUM (0.43) ALDH1A1KDM4EHPGDMAPTDHODH
SCHEMBL17915314 0.91 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDMAPTDHODH
SCHEMBL17915319 0.91 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDMAPTDHODH
SCHEMBL17915400 0.91 DHODH (0.43) ALDH1A1KDM4EHPGDMAPTDHODH
SCHEMBL17914765 0.91 NOTUM (0.44) ALDH1A1KDM4EHPGDMAPTDHODH

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-20160204357-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME HEESUNG MATERIAL LTD. (KR) 2016-07-14 — — US disclosed
US-20160204357-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME HEESUNG MATERIAL LTD. (KR) 2016-07-14 — — 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-20160204357-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME NOTUM, ORC3, PPOX ALDH1A1 277/4885KDM4E 2672/4885HPGD 2405/4885

“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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