SCHEMBL2384049

SCHEMBL2384049

CCc1cccc(NC(=O)N2CCN(c3nsnc3OCc3ccnc(NC(=O)CN4CCN(C)CC4)c3)CC2)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 5/20 0.48
▸ DRD4 P21917 5/20 0.48
▸ DRD3 P35462 3/20 0.48
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ ERBB2 P04626 1/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ P2RY12 Q9H244 2/20 0.38
▸ FAAH O00519 2/20 0.37
▸ PDE10A Q9Y233 1/20 0.37
▸ TGFBR1 P36897 2/20 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
SCHEMBL5573660 0.89 MEN1 (0.44) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL2383727 0.88 DRD2 (0.51) DRD2DRD4DRD3ALDH1A1RAB9A
SCHEMBL12250952 0.87 P2RY12 (0.41) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL2384081 0.86 TGFBR1 (0.41) ALDH1A1RAB9ATGFBR1
SCHEMBL2385186 0.83 MEN1 (0.43) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL2383147 0.83 MEN1 (0.45) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL12251100 0.82 DRD2 (0.42) DRD2DRD4DRD3ALDH1A1RAB9A
SCHEMBL2384352 0.80 MEN1 (0.42) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL2381720 0.80 TRPV1 (0.41) ALDH1A1TGFBR1
SCHEMBL2384694 0.79 TRPV1 (0.41) ALDH1A1TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 — — US claimed
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 — — US disclosed
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 — — US disclosed
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 — — US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 — — US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 — — US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 — — 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 (1 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-20070275952-A1 Tie-2 Modulators and Methods of Use TIE1, TEK, KDR DRD2 4047/4885DRD4 4354/4885DRD3 4521/4885

“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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