SCHEMBL30102567

SCHEMBL30102567

O=P(O)(O)OCc1cccnc1

nearest known ligand 0.77

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FDPS P14324 7/20 0.56
BTN3A1 O00481 1/20 0.54
PDE3A Q14432 1/20 0.54
NAPRT Q6XQN6 1/20 0.49
TSHR P16473 1/20 0.47
HDAC1 Q13547 1/20 0.47
CYP17A1 P05093 1/20 0.44
CYP19A1 P11511 1/20 0.44
GAA P10253 1/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2D6 P10635 1/20 0.44
LMNA P02545 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
RECQL P46063 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44

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
SCHEMBL207656 1.00 FDPS (0.56) FDPSBTN3A1PDE3ANAPRTTSHR
SCHEMBL8394763 0.98 FDPS (0.54) FDPSBTN3A1PDE3ANAPRTTSHR
SCHEMBL22235085 0.87 FDPS (0.50) FDPSBTN3A1PDE3ANAPRTTSHR
SCHEMBL17034259 0.86 FDPS (0.53) FDPSBTN3A1PDE3ANAPRTTSHR
SCHEMBL207655 0.85 FDPS (0.50) FDPSBTN3A1PDE3ANAPRTHDAC1
SCHEMBL18307752 0.82 FDPS (0.53) FDPSBTN3A1PDE3ANAPRTHDAC1
SCHEMBL22235083 0.82 FDPS (0.47) FDPSBTN3A1PDE3ANAPRTHDAC1
SCHEMBL11952576 0.81 FDPS (0.48) FDPSBTN3A1PDE3ANAPRTTSHR
SCHEMBL28384938 0.79 GAA (0.46) FDPSBTN3A1PDE3ANAPRTHDAC1
SCHEMBL19353234 0.78 LMNA (0.46) FDPSBTN3A1PDE3ACYP19A1GAA

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
CN-115572727-A Novel CRISPR enzymes and systems 布罗德研究所有限公司 2023-01-06 CN disclosed