SCHEMBL24045705

SCHEMBL24045705

O=C1C=CCCN1c1ccc(-c2ccncc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.38
AURKA O14965 2/20 0.36
TTK P33981 2/20 0.36
AURKB Q96GD4 2/20 0.36
INCENP Q9NQS7 2/20 0.36
EGLN1 Q9GZT9 1/20 0.36
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
LSS P48449 1/20 0.34
PDE3B Q13370 4/20 0.33
PDE3A Q14432 4/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
MTOR P42345 1/20 0.33
PIK3CG P48736 1/20 0.33
LARS1 Q9P2J5 1/20 0.33
DRD2 P14416 1/20 0.33
FAAH O00519 1/20 0.33
MGLL Q99685 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
SCHEMBL24045762 0.84 EGLN1 (0.38) AURKATTKAURKBINCENPEGLN1
SCHEMBL24045932 0.84 APP (0.47) CYP3A4ALDH1A1CYP1A2
SCHEMBL24045773 0.79 CHRNA7 (0.41) PDE3BPDE3AMTORFAAH
SCHEMBL15875300 0.76 FAAH (0.47) LMNAFAAHMGLLMEN1ALDH1A1
SCHEMBL24045716 0.76 FAAH (0.47) FAAHMGLLMEN1HPGDKMT2A
SCHEMBL24045892 0.75 TAAR1 (0.45) FAAHMGLLCYP3A4USP2CYP2D6
SCHEMBL24045795 0.75 MKNK1 (0.44) PIK3CASMN1; SMN2HTT
SCHEMBL24045791 0.75 CYP11B2 (0.38) MAPTSMN1; SMN2CYP2C19
SCHEMBL23168409 0.75 ALDH1A1 (0.53) LMNAMAPTSMN1; SMN2USP2KDM4E
SCHEMBL24045949 0.74 FPR1 (0.40) EGLN1

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-3414227-B1 PIPERIDINONE FORMYL PEPTIDE 2 RECEPTOR AND FORMYL PEPTIDE 1 RECEPTOR AGONISTS BRISTOL MYERS SQUIBB CO (US) 2021-11-24 EP disclosed