SCHEMBL30801898

SCHEMBL30801898

CC(CN1CCN2CCNC[C@@H]2C1=O)Oc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 4/20 0.37
▸ HTR2A P28223 2/20 0.37
▸ HTR2B P41595 2/20 0.37
▸ TAAR1 Q96RJ0 1/20 0.37
▸ LTA4H P09960 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ MTNR1A P48039 1/20 0.35
▸ MTNR1B P49286 1/20 0.35
▸ CHRNB4 P30926 2/20 0.34
▸ CHRNA3 P32297 2/20 0.34
▸ DPP4 P27487 1/20 0.33
▸ DPP7 Q9UHL4 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
SCHEMBL30801878 0.82 TAAR1 (0.39) HTR2CHTR2AHTR2BTAAR1RAB9A
SCHEMBL23573950 0.79 LTA4H (0.39) LTA4HNPC1RAB9AMTNR1AMTNR1B
SCHEMBL30801858 0.78 SLC6A2 (0.40) HTR2CHTR2AHTR2B
SCHEMBL30801735 0.76 HTR2A (0.37) HTR2CHTR2AHTR2B
SCHEMBL30801854 0.76 ZDHHC9 (0.38) —
SCHEMBL30801866 0.75 POLB (0.44) TAAR1
SCHEMBL30801806 0.74 HTR2A (0.35) HTR2CHTR2AHTR2B
SCHEMBL30801804 0.72 HTR2C (0.42) HTR2CHTR2AHTR2BTAAR1
SCHEMBL30801824 0.72 HSD11B1 (0.34) HTR2CHTR2AHTR2BDPP4
SCHEMBL30801792 0.72 HSD11B1 (0.36) HTR2CHTR2AHTR2BTAAR1

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-3793997-B1 FUSED BICYCLIC COMPOUNDS USEFUL AS UBIQUITIN-SPECIFIC PEPTIDASE 30 INHIBITORS FORMA THERAPEUTICS INC (US) 2024-03-13 — — EP claimed
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