SCHEMBL18486901

SCHEMBL18486901

c1cc2[nH]c(-c3n[nH]c4ccc(-c5cncc(CN6CCCCC6)c5)cc34)cc2cn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CLK2 P49760 19/20 1.00
CLK3 P49761 19/20 1.00
DYRK1A Q13627 19/20 1.00
WNT1 P04628 1/20 0.58
CHEK1 O14757 1/20 0.57
CDK7 P50613 1/20 0.57

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
SCHEMBL18444546 0.99 CLK2 (0.98) CLK2CLK3DYRK1AWNT1
SCHEMBL18447496 0.92 CLK2 (0.84) CLK2CLK3DYRK1AWNT1
SCHEMBL18446791 0.91 DYRK1A (0.83) CLK2CLK3DYRK1AWNT1CHEK1
SCHEMBL18446472 0.90 DYRK1A (0.81) CLK2CLK3DYRK1AWNT1CHEK1
SCHEMBL18437218 0.89 CLK2 (0.80) CLK2CLK3DYRK1ACHEK1
SCHEMBL18437208 0.88 CLK2 (0.79) CLK2CLK3DYRK1ACHEK1
SCHEMBL18439768 0.87 CLK2 (0.77) CLK2CLK3DYRK1AWNT1
SCHEMBL18481245 0.86 DYRK1A (1.00) CLK2CLK3DYRK1AWNT1
SCHEMBL20454932 0.86 CLK2 (0.85) CLK2CLK3DYRK1AWNT1
SCHEMBL18450823 0.86 CLK2 (0.76) CLK2CLK3DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10463651-B2 3-(1H-pyrrolo[3,2-C]pyridin-2-YL)-1H-indazoles and therapeutic uses thereof SAMUMED, LLC (US) 2019-11-05 US claimed
US-20180221350-A1 3-(1H-PYRROLO[3,2-C]PYRIDIN-2-YL)-1H-INDAZOLES AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI (PLAN) PTE. LTD. (SG) 2018-08-09 US claimed
US-20230000842-A1 METHODS OF TREATING CARTILAGE DISORDERS THROUGH INHIBITION OF CLK AND DYRK VICKERS-SPLICE CO-INVESTMENT LLC (KY) 2023-01-05 US disclosed
US-10463651-B2 3-(1H-pyrrolo[3,2-C]pyridin-2-YL)-1H-indazoles and therapeutic uses thereof SAMUMED, LLC (US) 2019-11-05 US disclosed
US-10463651-B2 3-(1H-pyrrolo[3,2-C]pyridin-2-YL)-1H-indazoles and therapeutic uses thereof SAMUMED, LLC (US) 2019-11-05 US disclosed
US-20180221350-A1 3-(1H-PYRROLO[3,2-C]PYRIDIN-2-YL)-1H-INDAZOLES AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI (PLAN) PTE. LTD. (SG) 2018-08-09 US disclosed
US-20180221350-A1 3-(1H-PYRROLO[3,2-C]PYRIDIN-2-YL)-1H-INDAZOLES AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI (PLAN) PTE. LTD. (SG) 2018-08-09 US disclosed
US-20180221350-A1 3-(1H-PYRROLO[3,2-C]PYRIDIN-2-YL)-1H-INDAZOLES AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI (PLAN) PTE. LTD. (SG) 2018-08-09 US disclosed
WO-2017024010-A1 3-(1H-PYRROLO[3,2-C]PYRIDIN-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 (3 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-10463651-B2 3-(1H-pyrrolo[3,2-C]pyridin-2-YL)-1H-indazoles and therapeutic uses thereof WNT1, WNT3, WNT3A CLK2 788/4885CLK3 683/4885DYRK1A 545/4885
US-20180221350-A1 3-(1H-PYRROLO[3,2-C]PYRIDIN-2-YL)-1H-INDAZOLES AND THERAPEUTIC USES THEREOF WNT1, WNT3, WNT3A CLK2 788/4885CLK3 683/4885DYRK1A 545/4885
US-20230000842-A1 METHODS OF TREATING CARTILAGE DISORDERS THROUGH INHIBITION OF CLK AND DYRK CLK2, CLK3, CLK1 CLK2 1/4885CLK3 2/4885DYRK1A 7/4885

“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.