SCHEMBL16905927

SCHEMBL16905927

c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc3c2sc2ccccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 3/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ TNKS O95271 2/20 0.36
▸ TNKS2 Q9H2K2 2/20 0.36
▸ PIK3CA P42336 1/20 0.34
▸ HRH4 Q9H3N8 1/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ MAPT P10636 3/20 0.32
▸ LMNA P02545 2/20 0.32
▸ NPSR1 Q6W5P4 2/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ MMP14 P50281 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ LIMK1 P53667 1/20 0.32
▸ CDK5 Q00535 1/20 0.32
▸ CDK5R1 Q15078 1/20 0.32

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
SCHEMBL16905911 0.98 ATM (0.38) ATML3MBTL1KDM4EMEN1KMT2A
SCHEMBL21599548 0.94 ATM (0.35) ATML3MBTL1KDM4EMEN1KMT2A
SCHEMBL19246968 0.94 ATM (0.38) ATML3MBTL1KDM4EMEN1KMT2A
SCHEMBL19247902 0.94 ATM (0.38) ATML3MBTL1KDM4EMEN1KMT2A
SCHEMBL19247821 0.94 ATM (0.38) ATML3MBTL1KDM4EMEN1KMT2A
SCHEMBL19246906 0.94 ATM (0.38) ATML3MBTL1KDM4EMEN1KMT2A
SCHEMBL16581191 0.94 ATM (0.38) ATML3MBTL1KDM4EMEN1KMT2A
SCHEMBL16581193 0.92 ATM (0.35) ATML3MBTL1KDM4EMEN1KMT2A
SCHEMBL19247982 0.92 ATM (0.35) ATML3MBTL1KDM4EMEN1KMT2A
SCHEMBL18273055 0.92 ATM (0.35) ATML3MBTL1KDM4EMEN1KMT2A

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-20160351826-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG SDI CO., LTD. (KR) 2016-12-01 — — US disclosed
WO-2015105315-A1 FUSED-RING COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 삼성에스디아이 주식회사 2015-07-16 — — WO 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-20160351826-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 ATM 1355/4885L3MBTL1 1170/4885KDM4E 3527/4885

“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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