SCHEMBL30778167

SCHEMBL30778167

Cc1cccnc1N1CCC(CN(C)C)CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.47
ADRA1D P25100 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
KMT2A Q03164 1/20 0.41
MALT1 Q9UDY8 2/20 0.40
TRPV1 Q8NER1 2/20 0.40
GRIN2B Q13224 1/20 0.40
DRD4 P21917 1/20 0.39
PDE10A Q9Y233 1/20 0.39
AOC3 Q16853 1/20 0.39
LCAT P04180 1/20 0.38
F13A1 P00488 1/20 0.38
TGM2 P21980 1/20 0.38
TGM1 P22735 1/20 0.38
TGM3 Q08188 1/20 0.38
SMO Q99835 1/20 0.38

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
SCHEMBL4716654 0.82 HSD11B1 (0.49) HSD11B1KMT2AMALT1TRPV1DRD4
SCHEMBL14587774 0.81 HSD11B1 (0.48) HSD11B1KMT2AMALT1TRPV1DRD4
SCHEMBL4769377 0.80 HSD11B1 (0.47) HSD11B1KMT2AMALT1TRPV1DRD4
Hydrochloric Acid SCHEMBL4422336 0.79 HSD11B1 (0.46) HSD11B1KMT2AMALT1TRPV1DRD4
SCHEMBL17206944 0.79 HSD11B1 (0.50) HSD11B1KMT2AMALT1TRPV1PDE10A
SCHEMBL3552058 0.79 KMT2A (0.61) HSD11B1KMT2AMALT1TRPV1PDE10A
SCHEMBL3436511 0.77 SMO (0.53) HSD11B1KMT2AMALT1TRPV1DRD4
SCHEMBL3436628 0.77 HSD11B1 (0.49) HSD11B1KMT2AMALT1TRPV1DRD4
SCHEMBL2804196 0.77 HSD11B1 (0.49) HSD11B1KMT2AMALT1TRPV1
SCHEMBL3436718 0.75 MALT1 (0.46) HSD11B1KMT2AMALT1TRPV1PDE10A

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
CN-113423708-B Imidazo [2,1-F ] [1,2,4] triazin-4-amine derivatives as TLR7 agonists 百济神州有限公司 2025-04-22 CN disclosed
EP-3921319-B1 IMIDAZO [2, 1-F] [1, 2, 4] TRIAZIN-4-AMINE DERIVATIVES AS TLR7 AGONIST BEIGENE LTD (KY) 2024-03-06 EP disclosed