SCHEMBL28103502

SCHEMBL28103502

O=CC1CCN(c2cccc(F)c2)N1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.47
▸ HTR2A P28223 1/20 0.42
▸ HTR2C P28335 1/20 0.42
▸ HTR2B P41595 1/20 0.42
▸ BPTF Q12830 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ POLB P06746 3/20 0.39
▸ MAPT P10636 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ FAAH O00519 1/20 0.38
▸ MGLL Q99685 1/20 0.38
▸ KDR P35968 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ADAMTS5 Q9UNA0 1/20 0.35
▸ METAP2 P50579 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ FADS1 O60427 1/20 0.35

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
SCHEMBL27743313 0.84 ALOX5 (0.48) ALOX5HTR2AHTR2CHTR2BALDH1A1
SCHEMBL27873897 0.82 ALOX5 (0.47) ALOX5ALDH1A1POLBGAAMGLL
SCHEMBL27873898 0.81 NOTUM (0.36) ALDH1A1POLBMAPTGAAMGLL
SCHEMBL27671224 0.81 ALOX5 (0.41) ALOX5GAAMEN1KMT2AL3MBTL1
SCHEMBL28835067 0.80 ALOX5 (0.49) ALOX5MAPTMGLLMEN1KMT2A
SCHEMBL28103275 0.79 PRMT6 (0.37) ALOX5
SCHEMBL27873899 0.78 SLC6A2 (0.38) ALOX5MGLL
SCHEMBL27529999 0.77 KAT2B (0.38) ALDH1A1POLBMAPTGAAMEN1
SCHEMBL28039321 0.75 ADRB1 (0.45) ALDH1A1MAPTL3MBTL1
SCHEMBL28063442 0.73 CHRNB2 (0.43) —

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-106061950-A Method for producing pyrazole compound 住友化学株式会社 2016-10-26 — — CN disclosed
Send feedback