SCHEMBL17273344

SCHEMBL17273344

Cc1ccc(S(=O)(=O)n2cc(-c3cnn(CCc4ccccc4)c3)c3cc(-c4cccc(NC5CCN(C(=O)OC(C)(C)C)CC5)c4)cnc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 1/20 0.38
▸ GPR119 Q8TDV5 3/20 0.37
▸ TGFBR1 P36897 1/20 0.37
▸ LMNA P02545 2/20 0.37
▸ TP53 P04637 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ RIPK2 O43353 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ PIK3CA P42336 1/20 0.37
▸ JAK2 O60674 1/20 0.37
▸ JAK3 P52333 1/20 0.37
▸ PTK2 Q05397 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ HTR6 P50406 2/20 0.36
▸ BRD4 O60885 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ LIMK2 P53671 1/20 0.36
▸ USP30 Q70CQ3 1/20 0.36
▸ CCNT1 O60563 1/20 0.36
▸ MET P08581 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
SCHEMBL17273295 0.90 TP53 (0.42) PTPN11GPR119TGFBR1LMNATP53
SCHEMBL17273389 0.89 PTPN11 (0.38) PTPN11GPR119LMNATP53MAPT
SCHEMBL15562340 0.87 MET (0.43) PTPN11GPR119LMNATP53MAPT
SCHEMBL17273503 0.87 PTPN11 (0.43) PTPN11GPR119LMNATP53MAPT
SCHEMBL17273324 0.87 GPR119 (0.40) PTPN11GPR119LMNATP53MAPT
SCHEMBL17273291 0.86 ALK (0.45) PTPN11GPR119LMNATP53MAPT
SCHEMBL17273413 0.85 RET (0.45) PTPN11GPR119LMNA
SCHEMBL17273514 0.85 CCNT1 (0.42) PTPN11GPR119TP53RIPK2PIK3CA
SCHEMBL15557795 0.83 GPR119 (0.43) GPR119TGFBR1MAPTPIK3CAJAK2
SCHEMBL17273395 0.83 ALK (0.48) —

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-9353107-B2 3-(pyrazolyl)-1H-pyrrolo[2,3-b]pyridine derivatives as kinase inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2016-05-31 — — US disclosed
US-20150336949-A1 3-(Pyrazolyl)-1H-Pyrrolo[2,3-b]Pyridine Derivatives as Kinase Inhibitors Um Pharmauji Sdn. Bhd. (MY) 2015-11-26 — — 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-20150336949-A1 3-(Pyrazolyl)-1H-Pyrrolo[2,3-b]Pyridine Derivatives as Kinase Inhibitors MAP3K3, MAP3K1, MAP3K6 PTPN11 564/4885GPR119 803/4885TGFBR1 2457/4885

“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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