SCHEMBL24083337

SCHEMBL24083337

Cc1nn[nH]c1C[C@H](C)OCC(=O)O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HCAR2 Q8TDS4 1/20 0.32

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
SCHEMBL28444434 0.82 — —
SCHEMBL28441754 0.82 — —
SCHEMBL22315710 0.70 HCAR2 (0.30) HCAR2
SCHEMBL22316983 0.70 HCAR2 (0.30) HCAR2
Hydrochloric Acid SCHEMBL28701463 0.69 — —
Hydrochloric Acid SCHEMBL28701466 0.69 — —
SCHEMBL5038982 0.65 NPC1 (0.50) —
Hydrochloric Acid SCHEMBL9460054 0.63 TBXAS1 (0.46) —
SCHEMBL17942070 0.62 MAPT (0.33) HCAR2
SCHEMBL12549579 0.62 — —

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
EP-3919498-A1 PYRROLOPYRIMIDINE DERIVATIVE AND USE THEREOF Wuhan Humanwell Innovative Drug Research and Development Center Limited Company (CN) 2021-12-08 — — EP disclosed
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