SCHEMBL20412337

SCHEMBL20412337

CN(C)CCOc1cc(F)cc(-c2ccnc3[nH]c(-c4n[nH]c5ccc(-c6cncc(NC(O)CC(C)(C)C)c6)cc45)cc23)c1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ WNT1 P04628 7/20 0.56
▸ CLK2 P49760 13/20 0.56
▸ DYRK1A Q13627 13/20 0.56
▸ CLK3 P49761 12/20 0.56

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
SCHEMBL20412335 0.93 CLK2 (0.58) WNT1CLK2DYRK1ACLK3
SCHEMBL20991375 0.92 CLK2 (0.60) WNT1CLK2DYRK1ACLK3
SCHEMBL20466192 0.92 CLK2 (0.55) WNT1CLK2DYRK1ACLK3
SCHEMBL18441206 0.90 CLK2 (0.67) WNT1CLK2DYRK1ACLK3
SCHEMBL18441802 0.88 CLK2 (0.70) WNT1CLK2DYRK1ACLK3
SCHEMBL18441595 0.87 CLK2 (0.69) WNT1CLK2DYRK1ACLK3
SCHEMBL18441848 0.87 WNT1 (0.60) WNT1CLK2DYRK1ACLK3
SCHEMBL20412334 0.87 CLK2 (0.56) WNT1CLK2DYRK1ACLK3
SCHEMBL18441601 0.86 WNT1 (0.57) WNT1CLK2DYRK1ACLK3
SCHEMBL18441579 0.86 CLK2 (0.63) WNT1CLK2DYRK1ACLK3

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-10350199-B2 3-(1h-pyrrolo[2,3-b]pyridin-2-yl)-1h-indazoles and therapeutic uses thereof SAMUMED, LLC (US) 2019-07-16 — — US disclosed
US-20180207141-A1 3-(1H-PYRROLO[2,3-B]PYRIDIN-2-YL)-1H-INDAZOLES AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI PTE. LTD. (SG) 2018-07-26 — — 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 (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-10350199-B2 3-(1h-pyrrolo[2,3-b]pyridin-2-yl)-1h-indazoles and therapeutic uses thereof WNT1, WNT3, WNT3A WNT1 1/4885CLK2 779/4885DYRK1A 513/4885
US-20180207141-A1 3-(1H-PYRROLO[2,3-B]PYRIDIN-2-YL)-1H-INDAZOLES AND THERAPEUTIC USES THEREOF WNT1, WNT3, WNT3A WNT1 1/4885CLK2 779/4885DYRK1A 513/4885

“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.

Send feedback