SCHEMBL17300198

SCHEMBL17300198

c1cc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc4ccccc4c3)n2)cc(-c2nc3ccccc3c3c4ccccc4c4ccccc4c23)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ ATM Q13315 1/20 0.40
▸ AURKA O14965 1/20 0.40
▸ AURKB Q96GD4 1/20 0.40
▸ ADORA2A P29274 3/20 0.40
▸ ADORA1 P30542 2/20 0.40
▸ CYP1A2 P05177 5/20 0.39
▸ NR1I3 Q14994 4/20 0.39
▸ CYP3A4 P08684 3/20 0.39
▸ CYP2C9 P11712 3/20 0.39
▸ CYP2B6 P20813 2/20 0.39
▸ AHR P35869 2/20 0.39
▸ VDR P11473 1/20 0.39
▸ HSD17B10 Q99714 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CYP2D6 P10635 2/20 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
SCHEMBL17915188 0.99 AURKA (0.40) MEN1KMT2AATMAURKAAURKB
SCHEMBL17915157 0.96 MEN1 (0.41) MEN1KMT2AATMAURKAAURKB
SCHEMBL17915012 0.95 MEN1 (0.42) MEN1KMT2AATMAURKAAURKB
SCHEMBL17915259 0.94 ATM (0.47) MEN1KMT2AATMAURKAAURKB
SCHEMBL17914799 0.94 CYP1A1 (0.46) MEN1KMT2AATMAURKAAURKB
SCHEMBL17914800 0.94 CYP1A1 (0.46) MEN1KMT2AATMAURKAAURKB
SCHEMBL17914758 0.93 HSD17B1 (0.42) MEN1KMT2AADORA2AADORA1CYP1A2
SCHEMBL17915303 0.92 CYP1A1 (0.45) MEN1KMT2AATMAURKAAURKB
SCHEMBL17915263 0.92 CYP1A1 (0.45) MEN1KMT2AATMAURKAAURKB
SCHEMBL17915273 0.92 ATM (0.46) MEN1KMT2AATMAURKAAURKB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10608189-B2 Condensed cyclic compounds and organic light-emitting devices including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-03-31 — — US disclosed
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
US-20150349275-A1 CONDENSED CYCLIC COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-12-03 — — US disclosed
US-20150349275-A1 CONDENSED CYCLIC COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-12-03 — — 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 (2 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-10608189-B2 Condensed cyclic compounds and organic light-emitting devices including the same CRY1, CRY2, CCNE2 MEN1 400/4885KMT2A 1753/4885ATM 1150/4885
US-20160204357-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME NOTUM, ORC3, PPOX MEN1 1392/4885KMT2A 760/4885ATM 3125/4885

“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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