SCHEMBL18446841

SCHEMBL18446841

CN(C)CCOc1cc(F)cc(-c2cccc3[nH]c(-c4n[nH]c5ccc(-c6cncc(OC7CCCCC7)c6)cc45)cc23)c1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CLK2 P49760 14/20 0.52
▸ DYRK1A Q13627 13/20 0.52
▸ WNT1 P04628 6/20 0.52
▸ CLK3 P49761 12/20 0.51
▸ TGFBR1 P36897 1/20 0.46

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
SCHEMBL18446261 0.94 WNT1 (0.54) CLK2DYRK1AWNT1CLK3TGFBR1
SCHEMBL18448414 0.93 DYRK1A (0.55) CLK2DYRK1AWNT1CLK3
SCHEMBL18453788 0.92 CLK2 (0.49) CLK2DYRK1AWNT1CLK3TGFBR1
SCHEMBL18447252 0.91 CLK2 (0.61) CLK2DYRK1AWNT1CLK3TGFBR1
SCHEMBL18495054 0.91 CLK2 (0.63) CLK2DYRK1AWNT1CLK3TGFBR1
SCHEMBL20455442 0.91 CLK2 (0.62) CLK2DYRK1AWNT1CLK3
SCHEMBL20397988 0.90 WNT1 (0.53) CLK2DYRK1AWNT1CLK3
SCHEMBL20451193 0.90 CLK2 (0.63) CLK2DYRK1AWNT1CLK3TGFBR1
SCHEMBL18447029 0.89 CLK3 (0.51) CLK2DYRK1AWNT1CLK3
SCHEMBL18447259 0.89 CLK2 (0.57) CLK2DYRK1AWNT1CLK3TGFBR1

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-10604512-B2 3-(1H-indol-2-yl)-1H-indazoles and therapeutic uses thereof SAMUMED, LLC (US) 2020-03-31 — — US 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 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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 640/4885DYRK1A 585/4885WNT1 1/4885
US-10604512-B2 3-(1H-indol-2-yl)-1H-indazoles and therapeutic uses thereof WNT1, WNT3, WNT3A CLK2 530/4885DYRK1A 413/4885WNT1 1/4885

“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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