SCHEMBL18447281

SCHEMBL18447281

COc1cncc(-c2ccc3[nH]nc(-c4cc5ccccc5[nH]4)c3c2)c1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CLK2 P49760 8/20 0.65
CLK3 P49761 8/20 0.65
DYRK1A Q13627 8/20 0.65
ITK Q08881 9/20 0.60
FGFR1 P11362 2/20 0.58
CHEK1 O14757 1/20 0.58
CDK4 P11802 1/20 0.58
CCNA2 P20248 1/20 0.58
CCND1 P24385 1/20 0.58
CDK2 P24941 1/20 0.58
CCND3 P30281 1/20 0.58
KDR P35968 1/20 0.58
CDK7 P50613 1/20 0.52

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
SCHEMBL18448285 0.89 CLK3 (0.67) CLK2CLK3DYRK1AITKCDK7
SCHEMBL20454878 0.89 CLK3 (0.69) CLK2CLK3DYRK1AITK
SCHEMBL18441732 0.87 CLK2 (0.73) CLK2CLK3DYRK1ACDK7
SCHEMBL18482627 0.86 CLK2 (0.52) CLK2CLK3DYRK1AITKFGFR1
SCHEMBL18446779 0.85 CLK3 (0.64) CLK2CLK3DYRK1AITKCHEK1
SCHEMBL18495485 0.85 CLK2 (0.59) CLK2CLK3DYRK1AITKFGFR1
SCHEMBL18446785 0.85 CLK2 (0.62) CLK2CLK3DYRK1AITKFGFR1
SCHEMBL20451184 0.85 CLK2 (0.60) CLK2CLK3DYRK1AITKFGFR1
SCHEMBL20451154 0.84 CLK2 (0.57) CLK2CLK3DYRK1AITKFGFR1
SCHEMBL18445979 0.84 CLK3 (0.66) CLK2CLK3DYRK1AITKFGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180222891-A1 3-(1H-INDOL-2-YL)-1H-INDAZOLES AND THERAPEUTIC USES THEREOF VICKERS-SPLICE CO-INVESTMENT LLC (KY) 2018-08-09 US claimed
WO-2017023986-A1 3-(1H-INDOL-2-YL)-1H-INDAZOLES AND THERAPEUTIC USES THEREOF SAMUMED, LLC (US) 2017-02-09 WO claimed
US-20180222891-A1 3-(1H-INDOL-2-YL)-1H-INDAZOLES AND THERAPEUTIC USES THEREOF VICKERS-SPLICE CO-INVESTMENT LLC (KY) 2018-08-09 US disclosed
US-20180222891-A1 3-(1H-INDOL-2-YL)-1H-INDAZOLES AND THERAPEUTIC USES THEREOF VICKERS-SPLICE CO-INVESTMENT LLC (KY) 2018-08-09 US disclosed
WO-2017023986-A1 3-(1H-INDOL-2-YL)-1H-INDAZOLES AND THERAPEUTIC USES THEREOF SAMUMED, LLC (US) 2017-02-09 WO 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-20180222891-A1 3-(1H-INDOL-2-YL)-1H-INDAZOLES AND THERAPEUTIC USES THEREOF WNT1, WNT3, WNT3A CLK2 640/4885CLK3 573/4885DYRK1A 585/4885

“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.