SCHEMBL29615014

SCHEMBL29615014

CN(C)CCNc1nc2ccccc2c2[nH]c3ccccc3c12

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 6/20 0.63
▸ TOP2A P11388 3/20 0.57
▸ NQO1 P15559 1/20 0.56
▸ GSK3A P49840 1/20 0.56
▸ GSK3B P49841 1/20 0.56
▸ PAX8 Q06710 1/20 0.55
▸ TLR9 Q9NR96 1/20 0.51
▸ POLB P06746 1/20 0.49
▸ RAD52 P43351 1/20 0.49
▸ SMARCA2 P51531 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ ALPG P10696 1/20 0.49
▸ NCF1 P14598 2/20 0.48
▸ ACP1 P24666 1/20 0.47
▸ DYRK1A Q13627 1/20 0.47
▸ CSNK2A1 P68400 1/20 0.46
▸ SLC2A1 P11166 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
SCHEMBL3510262 1.00 TERT (0.63) TERTTOP2ANQO1GSK3AGSK3B
SCHEMBL2967645 0.89 NQO1 (0.63) TERTTOP2ANQO1GSK3AGSK3B
Hydrochloric Acid SCHEMBL3508543 0.88 PAX8 (0.64) TERTTOP2ANQO1GSK3AGSK3B
Hydrochloric Acid SCHEMBL3511768 0.82 TERT (0.60) TERTNQO1GSK3AGSK3BPAX8
SCHEMBL2965102 0.82 NQO1 (0.55) TERTNQO1GSK3AGSK3BPAX8
SCHEMBL13243586 0.82 UTS2R (0.60) NQO1GSK3AGSK3BPAX8POLB
Hydrochloric Acid SCHEMBL3510900 0.81 PAX8 (0.56) TERTNQO1GSK3AGSK3BPAX8
SCHEMBL27199814 0.80 CSNK2A1 (0.48) TERTTOP2ANQO1GSK3AGSK3B
SCHEMBL3508559 0.78 DYRK1A (0.56) TERTNQO1GSK3AGSK3BPAX8
Hydrochloric Acid SCHEMBL3509482 0.78 TERT (0.52) TERTNQO1GSK3AGSK3BPAX8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022122668-A1 COMBINED INHIBITION OF AMINO ACID TRANSPORTERS FOR INHIBITING HUMAN PLASMACYTOID DENDRITIC CELL ACTIVITY DURING AUTOIMMUNITY MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2022-06-16 — — WO claimed
EP-4008330-A1 COMBINED INHIBITION OF AMINO ACID TRANSPORTERS FOR INHIBITING HUMAN PLASMACYTOID DENDRITIC CELL ACTIVITY DURING AUTOIMMUNITY Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2022-06-08 — — EP claimed
WO-2022122668-A1 COMBINED INHIBITION OF AMINO ACID TRANSPORTERS FOR INHIBITING HUMAN PLASMACYTOID DENDRITIC CELL ACTIVITY DURING AUTOIMMUNITY MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2022-06-16 — — WO disclosed
EP-4008330-A1 COMBINED INHIBITION OF AMINO ACID TRANSPORTERS FOR INHIBITING HUMAN PLASMACYTOID DENDRITIC CELL ACTIVITY DURING AUTOIMMUNITY Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2022-06-08 — — EP disclosed
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