SCHEMBL26053583

SCHEMBL26053583

O=C(c1nc(Cl)cs1)N1CCc2[nH]cnc2[C@H]1c1nc2ccccc2s1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TPH1 P17752 8/20 0.41
UBE2M P61081 9/20 0.40
DCUN1D1 Q96GG9 9/20 0.40
TP53 P04637 3/20 0.40
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
AOC3 Q16853 1/20 0.37
LMNA P02545 3/20 0.36
GAA P10253 1/20 0.36
GFER P55789 1/20 0.36
POLB P06746 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL26053478 0.90 TPH1 (0.43) TPH1UBE2MDCUN1D1TP53ALDH1A1
SCHEMBL26055110 0.89 UBE2M (0.38) TPH1UBE2MDCUN1D1ALDH1A1AOC3
SCHEMBL26053265 0.89 HPGD (0.46) TPH1UBE2MDCUN1D1TP53ALDH1A1
SCHEMBL26053579 0.88 TPH1 (0.41) TPH1UBE2MDCUN1D1TP53ALDH1A1
SCHEMBL26054205 0.88 UBE2M (0.37) TPH1UBE2MDCUN1D1TP53ALDH1A1
SCHEMBL26054888 0.87 AOC3 (0.33) TPH1UBE2MDCUN1D1ALDH1A1AOC3
SCHEMBL26053269 0.86 CASP3 (0.44) TPH1UBE2MDCUN1D1TP53ALDH1A1
SCHEMBL26053711 0.85 TPH1 (0.41) TPH1UBE2MDCUN1D1TP53ALDH1A1
SCHEMBL26053709 0.85 UBE2M (0.44) TPH1UBE2MDCUN1D1TP53ALDH1A1
SCHEMBL26053581 0.84 TPH1 (0.43) TPH1UBE2MDCUN1D1TP53ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023164237-A1 COMPOUNDS AND METHODS USEFUL FOR STABILIZING PHENYLALANINE HYDROXYLASE MUTATIONS AGIOS PHARMACEUTICALS, INC. (US) 2023-08-31 WO disclosed