SCHEMBL3123799

SCHEMBL3123799

[CH2]C1CCCN(C(N)=O)C1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ LMNA P02545 3/20 0.35
▸ HPGD P15428 1/20 0.34
▸ GLA P06280 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ CPN1 P15169 1/20 0.34
▸ CPB2 Q96IY4 1/20 0.34
▸ CA12 O43570 3/20 0.33
▸ CA1 P00915 3/20 0.33
▸ CA2 P00918 3/20 0.33
▸ CA9 Q16790 3/20 0.33
▸ PDE4B Q07343 3/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ HTT P42858 1/20 0.31

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
SCHEMBL8576163 0.79 F2 (0.48) CPN1CPB2
SCHEMBL6280009 0.79 F2 (0.48) CPN1CPB2
SCHEMBL478663 0.79 ALDH1A1 (0.39) ALDH1A1MAPK1LMNAHPGDCA12
SCHEMBL478739 0.78 HPGD (0.57) ALDH1A1LMNAHPGDHTT
SCHEMBL21271007 0.77 — —
SCHEMBL4598450 0.77 CA12 (0.52) ALDH1A1MAPK1CA12CA1CA2
SCHEMBL27449610 0.77 ALDH1A1 (0.37) ALDH1A1MAPK1LMNAHPGDGLA
SCHEMBL12668009 0.77 CA12 (0.52) ALDH1A1MAPK1CA12CA1CA2
SCHEMBL12669685 0.77 CA12 (0.52) ALDH1A1MAPK1CA12CA1CA2
SCHEMBL29389040 0.77 ALDH1A1 (0.37) ALDH1A1MAPK1LMNAHPGDGLA

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-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 — — US disclosed
WO-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 — — WO 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-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS PDE4A, PDE4B, PDE3B ALDH1A1 190/4885MAPK1 1371/4885LMNA 3769/4885

“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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