SCHEMBL19405263

SCHEMBL19405263

N#Cc1ccc(C2CCN(C(=O)OCc3ccccc3)C2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.57
SMN1; SMN2 Q16637 3/20 0.54
RAB9A P51151 3/20 0.54
NPC1 O15118 2/20 0.54
CYP2C19 P33261 1/20 0.52
ALDH1A1 P00352 1/20 0.51
POLB P06746 1/20 0.51
FNTA P49354 2/20 0.50
FNTB P49356 2/20 0.50
PGGT1B P53609 2/20 0.50
USP30 Q70CQ3 2/20 0.49
JAK2 O60674 1/20 0.47
JAK1 P23458 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
PRMT5 O14744 1/20 0.46
WDR77 Q9BQA1 1/20 0.46
HTR1A P08908 1/20 0.46

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
SCHEMBL3678518 0.93 SMN1; SMN2 (0.60) PDE4BSMN1; SMN2RAB9ANPC1CYP2C19
SCHEMBL19404812 0.85 PDE4B (0.60) PDE4BSMN1; SMN2RAB9ANPC1CYP2C19
SCHEMBL19405234 0.85 PDE4B (0.60) PDE4BSMN1; SMN2RAB9ANPC1CYP2C19
SCHEMBL31198971 0.85 PDE4B (0.60) PDE4BSMN1; SMN2RAB9ANPC1CYP2C19
SCHEMBL19405175 0.85 PDE4B (0.63) PDE4BSMN1; SMN2RAB9ANPC1CYP2C19
SCHEMBL26540027 0.84 SMN1; SMN2 (0.49) PDE4BSMN1; SMN2RAB9ANPC1CYP2C19
SCHEMBL19405228 0.82 GRIN2B (0.60) PDE4BSMN1; SMN2RAB9ANPC1CYP2C19
SCHEMBL29087342 0.82 SMN1; SMN2 (0.59) PDE4BSMN1; SMN2RAB9ANPC1CYP2C19
SCHEMBL26125128 0.81 PDE4B (0.54) PDE4BSMN1; SMN2RAB9ANPC1CYP2C19
SCHEMBL4035554 0.80 SMN1; SMN2 (0.72) PDE4BSMN1; SMN2RAB9ANPC1CYP2C19

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-20170275272-A1 6-HYDROXY-4-OXO-1,4-DIHYDROPYRIMIDINE-5-CARBOXAMIDES AS APJ AGONISTS BRISTOL-MYERS SQUIBB COMPANY 2017-09-28 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-20170275272-A1 6-HYDROXY-4-OXO-1,4-DIHYDROPYRIMIDINE-5-CARBOXAMIDES AS APJ AGONISTS AP2A1, P2RX5, AP3M1 PDE4B 283/4885SMN1; SMN2 4690/4885RAB9A 2103/4885

“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.