SCHEMBL20133196

SCHEMBL20133196

In1c2ccncc2c2ccc(-c3cccnc3)nc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
NPC1 O15118 2/20 0.47
CYP2A6 P11509 5/20 0.41
HSP90AA1 P07900 1/20 0.40
HSP90AB1 P08238 1/20 0.40
PTK2 Q05397 1/20 0.40
LIMK1 P53667 1/20 0.39
CYP19A1 P11511 4/20 0.39
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
CYP3A4 P08684 2/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CDC7 O00311 1/20 0.38
CDK2 P24941 1/20 0.38
USP2 O75604 1/20 0.37
HTT P42858 1/20 0.37
NCOA1 Q15788 1/20 0.37
NCOA3 Q9Y6Q9 1/20 0.37
AXL P30530 1/20 0.37

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
SCHEMBL22906620 0.84 MAPT (0.53) MAPTNPC1CYP2A6HSP90AA1HSP90AB1
SCHEMBL22906618 0.80 MAPT (0.46) MAPTNPC1CYP2A6HSP90AA1HSP90AB1
SCHEMBL20133108 0.76 CYP2A6 (0.48) NPC1CYP2A6CYP3A4CYP1A2
SCHEMBL20133255 0.74 CYP2A6 (0.44) CYP2A6PTK2LIMK1CYP19A1CYP3A4
SCHEMBL26789057 0.71 MAOA (0.44) DDB1CRBNALDH1A1AXL
SCHEMBL27097178 0.70 MAPT (0.41) MAPT
SCHEMBL14884092 0.69 NPC1 (0.59) MAPTNPC1CYP2A6HSP90AA1HSP90AB1
SCHEMBL20133002 0.69 MAPT (0.39) MAPTALDH1A1HTTHIPK2
SCHEMBL22907143 0.68 MAPT (0.53) MAPTLIMK1
SCHEMBL29547252 0.68 MAPT (0.53) MAPTLIMK1

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 MAPT 2531/4885NPC1 3571/4885CYP2A6 4070/4885
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE CRBN, VHL, UBQLN2 MAPT 5/4885NPC1 3216/4885CYP2A6 4674/4885
US-20200155690-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME CRBN, CBL, MDM2 MAPT 2531/4885NPC1 3571/4885CYP2A6 4070/4885
US-20180215731-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME CRBN, CBL, MDM2 MAPT 2531/4885NPC1 3571/4885CYP2A6 4070/4885

“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.