SCHEMBL29619680

SCHEMBL29619680

C[C@H](F)Oc1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NFE2L2 Q16236 1/20 0.40
SLC6A4 P31645 1/20 0.40
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
ACHE P22303 1/20 0.38
ALOX12 P18054 1/20 0.36
HTT P42858 1/20 0.36
ALDH1A3 P47895 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
SCHEMBL29619678 1.00 ALDH1A1 (0.48) ALDH1A1MEN1KMT2ANFE2L2SLC6A4
SCHEMBL28771457 1.00 ALDH1A1 (0.48) ALDH1A1MEN1KMT2ANFE2L2SLC6A4
SCHEMBL105035 0.82 ALDH1A3 (0.52) ALDH1A1MEN1KMT2ANFE2L2MAPT
SCHEMBL14865164 0.80 ACHE (0.46) ALDH1A1MEN1KMT2ASLC6A4LMNA
SCHEMBL8266849 0.79 ALDH1A1 (0.49) ALDH1A1MEN1KMT2ANFE2L2SLC6A4
SCHEMBL23912995 0.78 ALDH1A1 (0.52) ALDH1A1MEN1KMT2ANFE2L2SLC6A4
SCHEMBL2738300 0.78 MEN1 (0.39) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL3165936 0.78 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ANFE2L2SLC6A4
SCHEMBL12012135 0.78 TDP1 (0.48) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL14704027 0.78 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ANFE2L2SLC6A4

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-114539039-A Method for synthesizing chiral fluorophenethyl alcohol by photo-enzyme catalysis 广东省科学院微生物研究所(广东省微生物分析检测中心) 2022-05-27 CN disclosed