SCHEMBL17196475

SCHEMBL17196475

Nc1ccccc1-c1ccc2c3ccccc3n(-c3ccccc3)c2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.55
KDM4E B2RXH2 2/20 0.55
ATM Q13315 1/20 0.55
METAP2 P50579 2/20 0.44
ALDH1A1 P00352 4/20 0.43
HSD17B10 Q99714 1/20 0.43
DHFR P00374 1/20 0.42
HDAC4 P56524 1/20 0.41
CHEK1 O14757 1/20 0.41
IL1R1 P14778 1/20 0.39
KMT2A Q03164 3/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 2/20 0.38
MEN1 O00255 1/20 0.38
LIMK1 P53667 1/20 0.36
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36
MAPK8 P45983 1/20 0.33
HSPA1A P0DMV8 1/20 0.33
PABPC1 P11940 1/20 0.33

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
SCHEMBL21098259 0.94 L3MBTL1 (0.51) L3MBTL1KDM4EATMMETAP2ALDH1A1
SCHEMBL18847793 0.91 L3MBTL1 (0.55) L3MBTL1KDM4EATMMETAP2ALDH1A1
SCHEMBL25286288 0.88 L3MBTL1 (0.55) L3MBTL1KDM4EATMMETAP2ALDH1A1
SCHEMBL30368758 0.88 L3MBTL1 (0.55) L3MBTL1KDM4EATMMETAP2ALDH1A1
SCHEMBL21142134 0.87 L3MBTL1 (0.62) L3MBTL1KDM4EATMALDH1A1HSD17B10
SCHEMBL17125576 0.87 L3MBTL1 (0.62) L3MBTL1KDM4EATMALDH1A1HSD17B10
SCHEMBL17468688 0.86 KDM4E (0.49) L3MBTL1KDM4EATMMETAP2ALDH1A1
SCHEMBL20657065 0.85 L3MBTL1 (0.53) L3MBTL1KDM4EATMMETAP2ALDH1A1
SCHEMBL30001189 0.85 L3MBTL1 (0.53) L3MBTL1KDM4EATMMETAP2ALDH1A1
SCHEMBL15604922 0.85 L3MBTL1 (0.51) L3MBTL1KDM4EATMMETAP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210147375-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2021-05-20 US disclosed
US-10446765-B2 Heterocyclic compound and organic light emitting element using same HEESUNG MATERIAL LTD. (KR) 2019-10-15 US disclosed
WO-2019192954-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2019-10-10 WO disclosed
US-20170133602-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING SAME HEESUNG MATERIAL LTD. (KR) 2017-05-11 US disclosed
US-20170133602-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING SAME HEESUNG MATERIAL LTD. (KR) 2017-05-11 US disclosed
WO-2015160224-A1 MULTI-COMPONENT HOST MATERIAL AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2015-10-22 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 (3 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-20170133602-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING SAME CRY1, CRY2, PER2 L3MBTL1 995/4885KDM4E 1869/4885ATM 3417/4885
US-10446765-B2 Heterocyclic compound and organic light emitting element using same CRY1, CRY2, PER2 L3MBTL1 995/4885KDM4E 1869/4885ATM 3417/4885
US-20210147375-A1 MATERIALS FOR ELECTRONIC DEVICES PNMT, EFNA1, TES L3MBTL1 2057/4885KDM4E 1633/4885ATM 2836/4885

“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.