SCHEMBL17273313

SCHEMBL17273313

Cc1ccc(S(=O)(=O)n2cc(-c3cnn(Cc4ccccc4)c3)c3cc(-c4ccc(N5CCN(C(=O)OC(C)(C)C)CC5)cc4)cnc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ ALK Q9UM73 1/20 0.46
▸ PTPN11 Q06124 1/20 0.45
▸ SCD O00767 1/20 0.44
▸ SCD5 Q86SK9 1/20 0.44
▸ GPR119 Q8TDV5 3/20 0.43
▸ PIK3CA P42336 1/20 0.41
▸ WNT3A P56704 1/20 0.41
▸ CYP2C19 P33261 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ KDM1A O60341 1/20 0.39
▸ TUBB4A P04350 1/20 0.39
▸ TUBB P07437 1/20 0.39
▸ TUBA3C P0DPH7 1/20 0.39
▸ TUBA1B P68363 1/20 0.39
▸ TUBA4A P68366 1/20 0.39
▸ TUBB4B P68371 1/20 0.39

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
SCHEMBL15557891 0.95 MEN1 (0.45) MEN1KMT2AALKPTPN11SCD
SCHEMBL15554619 0.94 SCD (0.46) MEN1KMT2AALKPTPN11SCD
SCHEMBL17273366 0.94 ALK (0.44) MEN1KMT2AALKPTPN11SCD
SCHEMBL15556498 0.94 MEN1 (0.44) MEN1KMT2AALKPTPN11SCD
SCHEMBL17273291 0.94 ALK (0.45) MEN1KMT2AALKPTPN11SCD
SCHEMBL17273434 0.93 RET (0.44) MEN1KMT2APTPN11SCDSCD5
SCHEMBL17273527 0.91 MEN1 (0.42) MEN1KMT2AALKPTPN11SCD
SCHEMBL15557110 0.88 MEN1 (0.40) MEN1KMT2AALKPTPN11SCD
SCHEMBL15557190 0.88 RET (0.43) MEN1KMT2APTPN11SCDSCD5
SCHEMBL15556168 0.87 GPR119 (0.41) MEN1KMT2AALKPTPN11SCD

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 MEN1 3581/4885KMT2A 2319/4885ALK 408/4885

“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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