SCHEMBL31029069

SCHEMBL31029069

CC(C)(C)OC(=O)N1CC2(C=C(c3ccc([N+](=O)[O-])cc3F)C2)C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.47
▸ MAPT P10636 4/20 0.47
▸ LMNA P02545 3/20 0.47
▸ THRB P10828 2/20 0.36
▸ SLC22A12 Q96S37 1/20 0.36
▸ RORC P51449 1/20 0.35
▸ GPR119 Q8TDV5 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ALOX5AP P20292 1/20 0.35
▸ FEN1 P39748 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ GABRA1 P14867 1/20 0.35
▸ GABRG2 P18507 1/20 0.35
▸ GABRB3 P28472 1/20 0.35
▸ GABRA5 P31644 1/20 0.35
▸ GABRA3 P34903 1/20 0.35
▸ GABRA2 P47869 1/20 0.35
▸ GABRA6 Q16445 1/20 0.35
▸ GAA P10253 1/20 0.34

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
SCHEMBL31639417 0.86 MAPT (0.44) ALDH1A1MAPTLMNATHRBRORC
SCHEMBL31158852 0.85 SMN1; SMN2 (0.40) RORCGPR119ALOX5APFEN1SMN1; SMN2
SCHEMBL31158858 0.82 APP (0.42) MAPTRORCGPR119ALOX5APFEN1
SCHEMBL31159140 0.80 PDK2 (0.40) RORCGPR119KMT2AALOX5APFEN1
SCHEMBL10036179 0.79 PDK4 (0.51) ALDH1A1MAPTLMNA
SCHEMBL29535433 0.79 PDK4 (0.51) ALDH1A1MAPTLMNA
SCHEMBL31334845 0.78 ALDH1A1 (0.45) ALDH1A1MAPTLMNATHRBGPR119
SCHEMBL22179574 0.77 ALDH1A1 (0.51) ALDH1A1MAPTLMNATHRBKMT2A
SCHEMBL31548463 0.77 ALDH1A1 (0.51) ALDH1A1MAPTLMNATHRBKMT2A
SCHEMBL31029044 0.76 MAPT (0.46) ALDH1A1MAPTLMNATHRBRORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4638433-A1 NAMPT MODULATORS Cytokinetics, Inc. (US) 2025-10-29 — — EP disclosed
WO-2024137981-A1 NAMPT MODULATORS CYTOKINETICS, INCORPORATED (US) 2024-06-27 — — WO disclosed
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