SCHEMBL20160860

SCHEMBL20160860

Brc1cccc(N2c3ccccc3S(c3ccccc3)(c3ccccc3)c3ccccc32)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 1/20 0.44
▸ ATM Q13315 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ MEN1 O00255 5/20 0.37
▸ KMT2A Q03164 5/20 0.37
▸ BCL2A1 Q16548 1/20 0.33
▸ POLB P06746 2/20 0.33
▸ DHFR P00374 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ ALKBH5 Q6P6C2 1/20 0.33
▸ BRD2 P25440 1/20 0.32
▸ DCTPP1 Q9H773 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ GSK3A P49840 1/20 0.31
▸ GSK3B P49841 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ HTT P42858 1/20 0.31

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
SCHEMBL20029201 0.89 FAAH (0.35) MGLLATML3MBTL1GAAALDH1A1
SCHEMBL19335699 0.81 CES2 (0.32) GAAALDH1A1
SCHEMBL17006280 0.79 MGLL (0.55) MGLLATML3MBTL1MEN1KMT2A
SCHEMBL22731541 0.75 MGLL (0.44) MGLLGSK3AGSK3B
SCHEMBL19036019 0.74 RXFP1 (0.31) —
SCHEMBL20387765 0.74 MAPT (0.32) MAPT
SCHEMBL24140688 0.73 ALDH1A1 (0.41) MGLLATMMEN1KMT2APOLB
SCHEMBL18776344 0.73 MGLL (0.52) MGLLATML3MBTL1MEN1KMT2A
SCHEMBL19335709 0.73 CHRNA7 (0.33) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL21726022 0.73 KDM4E (0.45) ATML3MBTL1ALDH1A1KDM4E

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-10673000-B2 Heterocyclic compound and organic electroluminescence device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-06-02 — — US disclosed
US-20180138429-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2018-05-17 — — 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-20180138429-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME ODC1, KCNC1, KCNH1 MGLL 3917/4885ATM 3695/4885L3MBTL1 3311/4885
US-10673000-B2 Heterocyclic compound and organic electroluminescence device including the same ODC1, KCNC1, KCNH1 MGLL 3917/4885ATM 3695/4885L3MBTL1 3311/4885

“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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