SCHEMBL5490129

SCHEMBL5490129

CCOc1cc2c(cc1OCC)C(c1ccc(Cl)cc1)=NN(C)C(=O)C2

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 8/20 0.47
TP53 P04637 4/20 0.47
LMNA P02545 2/20 0.38
GAA P10253 1/20 0.38
TSPO P30536 1/20 0.38
MDM4 O15151 4/20 0.38
ACHE P22303 2/20 0.37
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TSHR P16473 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
MAPK1 P28482 1/20 0.35
CYP2C19 P33261 1/20 0.35
MAPT P10636 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
SCHEMBL5486147 0.87 MAPK1 (0.47) LMNAGAATSPOSMN1; SMN2CYP1A2
SCHEMBL5493764 0.86 MAPK1 (0.49) LMNAGAATSPOSMN1; SMN2CYP1A2
SCHEMBL6625966 0.77 MAPK10 (0.42) POLBCYP1A2CYP3A4CYP2C9MAPK1
SCHEMBL5493513 0.75 GABRA5 (0.41) MDM2TP53LMNAACHEPOLB
SCHEMBL5484921 0.75 CYP1A2 (0.50) TP53LMNAGAASMN1; SMN2CYP1A2
SCHEMBL5484053 0.75 CYP1A2 (0.50) LMNAGAAACHESMN1; SMN2CYP1A2
SCHEMBL5492941 0.75 CYP1A2 (0.47) LMNAGAAACHESMN1; SMN2CYP1A2
SCHEMBL29942019 0.75 CYP1A2 (0.62) LMNAGAASMN1; SMN2CYP1A2CYP3A4
SCHEMBL5492316 0.75 ALDH1A1 (0.53) TP53LMNAGAASMN1; SMN2CYP1A2
SCHEMBL5490244 0.74 CYP1A2 (0.46) LMNAGAASMN1; SMN2TSHRCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040152888-A1 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof BAY CITY CAPITAL LLC 2004-08-05 US claimed
US-7250410-B2 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof VIA PHARMACEUTICALS, INC. (US) 2007-07-31 US disclosed
US-20040152888-A1 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof BAY CITY CAPITAL LLC 2004-08-05 US disclosed
EP-1392663-A2 CYCLIC NUCLEOTIDE PHOSPHODIESTERASE INHIBITORS, PREPARATION AND USES THEREOF NEURO3D (FR) 2004-03-03 EP disclosed
WO-2002098865-A2 CYCLIC NUCLEOTIDE PHOSPHODIESTERASE INHIBITORS, PREPARATION AND USES THEREOF NEURO3D (FR) 2002-12-12 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-20040152888-A1 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof PDE7A, PDE3B, PDE3A MDM2 4824/4885TP53 4880/4885LMNA 1410/4885

“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.