SCHEMBL18030960

SCHEMBL18030960

Cn1c2ccccc2c2ccc(-n3c4ccc(C#N)cc4c4cccc(C#N)c43)cc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 5/20 0.37
▸ MEN1 O00255 4/20 0.37
▸ KMT2A Q03164 4/20 0.37
▸ HCRTR1 O43613 1/20 0.36
▸ MAPT P10636 4/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ GPR3 P46089 1/20 0.36
▸ ALKBH5 Q6P6C2 1/20 0.35
▸ FTO Q9C0B1 1/20 0.35
▸ KIF11 P52732 1/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ TLR9 Q9NR96 1/20 0.35
▸ EGFR P00533 1/20 0.35
▸ SRC P12931 1/20 0.35
▸ IMPDH2 P12268 1/20 0.35

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
SCHEMBL18030984 0.95 MEN1 (0.37) L3MBTL1MEN1KMT2AHCRTR1MAPT
SCHEMBL18028327 0.92 GPR3 (0.42) L3MBTL1MEN1KMT2AMAPTKDM4E
SCHEMBL18028324 0.90 GPR3 (0.42) L3MBTL1MEN1KMT2AHCRTR1MAPT
SCHEMBL18055744 0.89 BCHE (0.39) L3MBTL1MEN1KMT2AMAPTKDM4E
SCHEMBL18031006 0.88 GPR3 (0.43) L3MBTL1MEN1KMT2AMAPTKDM4E
SCHEMBL17034462 0.88 GPR3 (0.43) L3MBTL1MEN1KMT2AHCRTR1MAPT
SCHEMBL18031009 0.88 GPR3 (0.43) L3MBTL1MEN1KMT2AHCRTR1MAPT
SCHEMBL18031027 0.88 GPR3 (0.43) L3MBTL1MEN1KMT2AHCRTR1MAPT
SCHEMBL18031028 0.86 GPR3 (0.43) L3MBTL1MEN1KMT2AHCRTR1MAPT
SCHEMBL18055745 0.84 BCHE (0.40) L3MBTL1MEN1KMT2AMAPTKDM4E

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-20170098781-A1 NEW DIBENZOFURANS AND DIBENZOTHIOPHENES IDEMITSU KOSAN CO., LTD. (JP) 2017-04-06 — — US disclosed
US-20160248026-A1 NITRILE SUBSTITUTED DIBENZOFURANS IDEMITSU KOSAN CO., LTD. (JP) 2016-08-25 — — 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-20170098781-A1 NEW DIBENZOFURANS AND DIBENZOTHIOPHENES DBF4, DDT, SLC43A3 L3MBTL1 2157/4885MEN1 1419/4885KMT2A 3930/4885
US-20160248026-A1 NITRILE SUBSTITUTED DIBENZOFURANS DBF4, NXF1, NCF1 L3MBTL1 2762/4885MEN1 1469/4885KMT2A 4257/4885

“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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