SCHEMBL4828079

SCHEMBL4828079

Cn1nc2ccc(Sc3ncccc3C(=O)NCc3ccc(C(C)(C)O)cc3F)cc2n1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 2/20 0.42
ATM Q13315 1/20 0.42
NPC1 O15118 2/20 0.40
KMT2A Q03164 5/20 0.40
ALDH1A1 P00352 3/20 0.40
MEN1 O00255 1/20 0.38
EPHX2 P34913 1/20 0.36
NR1H4 Q96RI1 1/20 0.36
RAB9A P51151 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.35
PTGER4 P35408 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
SCHEMBL4828083 0.88 POLB (0.43) POLBSMN1; SMN2LMNAATMNPC1
SCHEMBL4830144 0.82 PDE4A (0.51) LMNA
SCHEMBL14193556 0.74 SMN1; SMN2 (0.54) POLBSMN1; SMN2LMNAATMNPC1
SCHEMBL4830170 0.74 POLB (0.54) POLBSMN1; SMN2LMNAATMNPC1
SCHEMBL4825914 0.72 POLB (0.44) POLBSMN1; SMN2LMNAATMNPC1
SCHEMBL4831852 0.70 ATM (0.42) POLBSMN1; SMN2LMNAATMNPC1
SCHEMBL4830151 0.70 PDE2A (0.41) POLBSMN1; SMN2LMNANPC1KMT2A
SCHEMBL7370389 0.70 PDE4A (0.54) LMNAKMT2A
SCHEMBL4828112 0.69 PDE4A (0.53) LMNA
SCHEMBL4830104 0.69 PDE4A (0.51) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030186989-A1 Nicotinamide benzofused-heterocyclyl derivatives useful as selective inhibitors of pde4 isozymes PFIZER INC. 2003-10-02 US claimed
US-7354941-B2 Nicotinamide benzofused-heterocyclyl derivatives useful as selective inhibitors of PDE4 isozymes PFIZER PRODUCTS INC. (US) 2008-04-08 US disclosed
US-7354941-B2 Nicotinamide benzofused-heterocyclyl derivatives useful as selective inhibitors of PDE4 isozymes PFIZER PRODUCTS INC. (US) 2008-04-08 US disclosed
US-7354941-B2 Nicotinamide benzofused-heterocyclyl derivatives useful as selective inhibitors of PDE4 isozymes PFIZER PRODUCTS INC. (US) 2008-04-08 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-20030186989-A1 Nicotinamide benzofused-heterocyclyl derivatives useful as selective inhibitors of pde4 isozymes PDE4B, PDE4A, NOX4 POLB 2221/4885SMN1; SMN2 1930/4885LMNA 4406/4885

“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.