SCHEMBL18158867

SCHEMBL18158867

c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc5c4sc4ncccc45)ccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ TLR5 O60602 1/20 0.37
▸ KAT2B Q92831 1/20 0.34
▸ CLK1 P49759 2/20 0.33
▸ NPY5R Q15761 1/20 0.33
▸ PIK3CA P42336 2/20 0.32
▸ PTGER4 P35408 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ TSHR P16473 2/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ LIMK1 P53667 2/20 0.32
▸ CDC7 O00311 1/20 0.32
▸ DBF4 Q9UBU7 1/20 0.32
▸ MEN1 O00255 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ BRCA1 P38398 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL10449643 0.89 KDM4E (0.34) KDM4EATML3MBTL1TLR5KAT2B
SCHEMBL21481427 0.84 KDM4E (0.36) KDM4EATML3MBTL1NPY5RPTGER4
SCHEMBL15317382 0.84 PIK3CA (0.32) NPY5RPIK3CA
SCHEMBL10331557 0.82 ATM (0.45) KDM4EATML3MBTL1PTGER4ALDH1A1
SCHEMBL30021388 0.82 ATM (0.45) KDM4EATML3MBTL1PTGER4ALDH1A1
SCHEMBL10331507 0.82 ATM (0.45) KDM4EATML3MBTL1PTGER4ALDH1A1
SCHEMBL2549789 0.82 ATM (0.45) KDM4EATML3MBTL1PTGER4ALDH1A1
SCHEMBL10331556 0.82 ATM (0.45) KDM4EATML3MBTL1PTGER4ALDH1A1
SCHEMBL17640315 0.81 L3MBTL1 (0.44) KDM4EATML3MBTL1PTGER4ALDH1A1
SCHEMBL15685602 0.81 ATM (0.44) KDM4EATML3MBTL1PTGER4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170012216-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG SDI CO., LTD. (KR) 2017-01-12 — — US disclosed
US-20170012216-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG SDI CO., LTD. (KR) 2017-01-12 — — US disclosed
US-20160308142-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-10-20 — — US disclosed
US-20160308142-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-10-20 — — 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-20160308142-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 KDM4E 3527/4885ATM 1355/4885L3MBTL1 1170/4885
US-20170012216-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 KDM4E 3527/4885ATM 1355/4885L3MBTL1 1170/4885

“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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