SCHEMBL20132976

SCHEMBL20132976

In1c2ccncc2c2ccc(-c3ccccn3)cc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 2/20 0.43
CYP2A6 P11509 1/20 0.43
MAPT P10636 1/20 0.42
IRAK4 Q9NWZ3 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
MAOA P21397 4/20 0.38
MAOB P27338 4/20 0.38
ACHE P22303 1/20 0.38
TGFBR1 P36897 3/20 0.36
TGFBR2 P37173 1/20 0.36
PRMT5 O14744 2/20 0.36
WDR77 Q9BQA1 1/20 0.36
CNR2 P34972 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
MAPK14 Q16539 1/20 0.35
PIK3CD O00329 1/20 0.35
PIK3CA P42336 1/20 0.35
PI4KA P42356 1/20 0.35
PIK3CG P48736 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
SCHEMBL22906551 0.83 MAOA (0.41) METAP2MAOAMAOBACHEPIK3CA
SCHEMBL20132979 0.80 METAP2 (0.40) METAP2MAPTMAOAMAOBACHE
SCHEMBL20133255 0.79 CYP2A6 (0.44) METAP2CYP2A6PIK3CACYP1A2
SCHEMBL21658134 0.76 MAOA (0.59) HDAC2MAOAMAOBACHEKDM4E
SCHEMBL26789057 0.73 MAOA (0.44) MAOAMAOBACHE
SCHEMBL20443474 0.73 METAP2 (0.33) METAP2MAPTMAOAMAOBACHE
SCHEMBL20133108 0.72 CYP2A6 (0.48) CYP2A6CYP1A2
SCHEMBL22906839 0.72 ACHE (0.42) CYP2A6MAPTMAOAMAOBACHE
SCHEMBL13471364 0.71 CYP2A6 (0.41) CYP2A6MAPTIRAK4HRH3
SCHEMBL15696765 0.69 CYP2A6 (0.45) METAP2CYP2A6MAPTHDAC1HDAC2

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-20230183209-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME ARVINAS OPERATIONS, INC. (US) 2023-06-15 US disclosed
US-20200155690-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME ARVINAS OPERATIONS, INC. 2020-05-21 US disclosed
US-20180215731-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME ARVINAS OPERATIONS, INC. 2018-08-02 US disclosed
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2018-05-10 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 (4 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-20230183209-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME CRBN, CBL, MDM2 METAP2 1019/4885CYP2A6 4070/4885MAPT 2531/4885
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE CRBN, VHL, UBQLN2 METAP2 954/4885CYP2A6 4674/4885MAPT 5/4885
US-20200155690-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME CRBN, CBL, MDM2 METAP2 1019/4885CYP2A6 4070/4885MAPT 2531/4885
US-20180215731-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME CRBN, CBL, MDM2 METAP2 1019/4885CYP2A6 4070/4885MAPT 2531/4885

“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.