SCHEMBL23925319

SCHEMBL23925319

Fc1cccc(CBr)c1N1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
KMT2A Q03164 5/20 0.38
RAB9A P51151 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
NPC1 O15118 2/20 0.36
CASP3 P42574 2/20 0.36
SENP8 Q96LD8 2/20 0.36
SENP7 Q9BQF6 2/20 0.36
SENP6 Q9GZR1 2/20 0.36
TSHR P16473 2/20 0.36
LMNA P02545 1/20 0.36
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.35
MAPK1 P28482 1/20 0.35
MPI P34949 1/20 0.35
KMO O15229 1/20 0.35
CYP2A13 Q16696 1/20 0.34
POLB P06746 2/20 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
SCHEMBL23925316 0.85 MEN1 (0.36) ALDH1A1KMT2ARAB9ANPC1KDM4E
SCHEMBL23925265 0.82 ALDH1A1 (0.43) ALDH1A1KMT2ARAB9ASMN1; SMN2L3MBTL1
SCHEMBL5907586 0.81 TAAR1 (0.50) ALDH1A1KMT2ARAB9ASMN1; SMN2L3MBTL1
SCHEMBL5907582 0.79 TAAR1 (0.48) ALDH1A1KMT2ARAB9ASMN1; SMN2L3MBTL1
SCHEMBL30407583 0.76 RAB9A (0.42) ALDH1A1KMT2ARAB9ASMN1; SMN2L3MBTL1
SCHEMBL3879922 0.74 LMNA (0.42) ALDH1A1KMT2ARAB9ASMN1; SMN2L3MBTL1
SCHEMBL23536505 0.73 MAOB (0.39) ALDH1A1KMT2ARAB9ATSHRKDM4E
SCHEMBL23064539 0.72 ALDH1A1 (0.48) ALDH1A1KMT2ARAB9ASMN1; SMN2L3MBTL1
SCHEMBL30667343 0.72 KEAP1 (0.47) ALDH1A1KMT2ARAB9ASMN1; SMN2L3MBTL1
SCHEMBL23536171 0.71 MAOB (0.37) ALDH1A1KMT2ARAB9AMEN1

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
WO-2021209490-A1 CYCLAMINEPHENYLAMINOQUINOLINES AS FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 2021-10-21 WO disclosed