SCHEMBL22006092

SCHEMBL22006092

O=C1NCCCC1N1C(=O)c2cnc(N3CCNCC3)nc2C1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 17/20 0.41
▸ ALDH1A1 P00352 16/20 0.41
▸ CASP1 P29466 16/20 0.41
▸ CASP7 P55210 16/20 0.41
▸ HSD17B10 Q99714 15/20 0.41
▸ TSHR P16473 6/20 0.41
▸ CYP3A4 P08684 14/20 0.39
▸ CYP2C9 P11712 11/20 0.39
▸ HIF1A Q16665 10/20 0.39
▸ CYP2C19 P33261 9/20 0.39
▸ HPGD P15428 7/20 0.39
▸ USP2 O75604 11/20 0.38
▸ LMNA P02545 4/20 0.38
▸ CLK4 Q9HAZ1 3/20 0.38
▸ PIK3R1 P27986 1/20 0.37
▸ PIK3CA P42336 1/20 0.37
▸ GLA P06280 4/20 0.37
▸ ALOX15 P16050 1/20 0.36
▸ MEN1 O00255 5/20 0.36
▸ KMT2A Q03164 5/20 0.36

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
SCHEMBL20231888 0.83 CRBN (0.50) CYP1A2ALDH1A1TSHR
SCHEMBL30892113 0.83 CRBN (0.50) CYP1A2ALDH1A1TSHR
SCHEMBL22006091 0.80 CRBN (0.39) CYP1A2ALDH1A1CASP1
SCHEMBL22297288 0.72 CRBN (0.57) CYP1A2ALDH1A1TSHR
SCHEMBL845434 0.69 CRBN (0.57) CYP1A2ALDH1A1HSD17B10TSHRHPGD
SCHEMBL30892104 0.67 CRBN (0.56) CYP1A2ALDH1A1TSHR
SCHEMBL18263933 0.65 CRBN (0.55) CYP1A2ALDH1A1HSD17B10TSHRHPGD
SCHEMBL3125601 0.65 CRBN (0.55) CYP1A2ALDH1A1HSD17B10TSHRHPGD
SCHEMBL27099145 0.64 CRBN (0.54) CYP1A2ALDH1A1TSHR
SCHEMBL9684472 0.64 ALDH1A1 (0.46) CYP1A2ALDH1A1CASP1CASP7HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200155690-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME ARVINAS OPERATIONS, INC. 2020-05-21 — — 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-20200155690-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME CRBN, CBL, MDM2 CYP1A2 4681/4885ALDH1A1 3671/4885CASP1 3634/4885

“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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