SCHEMBL13490835

SCHEMBL13490835

COCOc1cccc(CN(C(=O)C2=C(c3cccc(-c4ccccc4)c3)CCN(C(=O)OC(C)(C)C)C2)C2CC2)c1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.41
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
USP30 Q70CQ3 3/20 0.38
GPR119 Q8TDV5 8/20 0.37
MGAT2 Q10469 1/20 0.36
DGAT2 Q96PD7 1/20 0.36
P2RX3 P56373 1/20 0.36
ROCK2 O75116 1/20 0.36
UBE2M P61081 1/20 0.36
DCUN1D1 Q96GG9 1/20 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
SCHEMBL8263362 0.93 SLC2A1 (0.40) SLC2A1JAK2JAK1USP30GPR119
SCHEMBL13490836 0.93 SLC2A1 (0.40) SLC2A1JAK2JAK1USP30GPR119
SCHEMBL8262771 0.93 GPR119 (0.39) SLC2A1JAK2JAK1USP30GPR119
SCHEMBL8265157 0.93 SLC2A1 (0.43) SLC2A1JAK2JAK1USP30GPR119
SCHEMBL13490821 0.90 JAK2 (0.49) JAK2JAK1USP30GPR119UBE2M
SCHEMBL13490824 0.89 JAK2 (0.42) JAK2JAK1USP30GPR119MGAT2
SCHEMBL8264159 0.89 GPR119 (0.42) SLC2A1JAK2JAK1USP30GPR119
SCHEMBL8263872 0.88 JAK2 (0.43) JAK2JAK1USP30GPR119
SCHEMBL8264180 0.87 JAK2 (0.43) JAK2JAK1USP30GPR119UBE2M
SCHEMBL8263838 0.87 GPR119 (0.41) JAK2JAK1USP30GPR119

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-20100029647-A1 3,4,(5)-SUBSTITUTED TETRAHYDROPHYRIDINES NOVARTIS AG (CH) 2010-02-04 US disclosed
US-20100029647-A1 3,4,(5)-SUBSTITUTED TETRAHYDROPHYRIDINES NOVARTIS AG (CH) 2010-02-04 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-20100029647-A1 3,4,(5)-SUBSTITUTED TETRAHYDROPHYRIDINES REN, PAH, ACE SLC2A1 1474/4885JAK2 415/4885JAK1 1610/4885

“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.