Phenol

Phenol

SCHEMBL28709666

O=C(O)C1CNCCN1.Oc1ccccc1

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.41
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
GLA P06280 1/20 0.38
CA3 P07451 1/20 0.38
CA4 P22748 1/20 0.38
CA9 Q16790 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CA14 Q9ULX7 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
DRD2 P14416 2/20 0.34
DRD1 P21728 1/20 0.34
JAK3 P52333 1/20 0.34
KMT2A Q03164 1/20 0.34
GRIK1 P39086 1/20 0.34
DRD3 P35462 1/20 0.33

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
SCHEMBL162294 0.83
SCHEMBL170308 0.83
SCHEMBL172309 0.83
Hydrochloric Acid SCHEMBL283015 0.81 CYP2D6 (0.41) TSHRKMT2A
Hydrochloric Acid SCHEMBL780213 0.81 CYP2D6 (0.41) TSHRKMT2A
SCHEMBL28853863 0.81 CYP2D6 (0.41) TSHRKMT2A
SCHEMBL4492257 0.81 CYP2D6 (0.41) TSHRKMT2A
Hydrochloric Acid SCHEMBL191366 0.81 CYP2D6 (0.41) TSHRKMT2A
SCHEMBL28861034 0.81 CYP2D6 (0.41) TSHRKMT2A
Ammonia Solution, Strong SCHEMBL27527361 0.81 CYP2D6 (0.41) TSHRKMT2A

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-114292249-A Cannabidiol-2-piperazinoate and application thereof 中国农业科学院农产品加工研究所 2022-04-08 CN disclosed