SCHEMBL29985682

SCHEMBL29985682

C[C@H](COc1cccc(Br)c1)Oc1cccc(Br)c1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.50
HSD17B10 Q99714 1/20 0.50
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 3/20 0.48
LMNA P02545 1/20 0.47
KMT2A Q03164 2/20 0.44
MAPT P10636 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.43

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
SCHEMBL20535109 1.00 MAOB (0.50) MAOBHSD17B10ALDH1A1KDM4ELMNA
SCHEMBL20535111 1.00 MAOB (0.50) MAOBHSD17B10ALDH1A1KDM4ELMNA
SCHEMBL19384211 0.86 MAOB (0.50) MAOBHSD17B10ALDH1A1KDM4ELMNA
SCHEMBL19384591 0.86 MAOB (0.50) MAOBHSD17B10ALDH1A1KDM4ELMNA
SCHEMBL19384391 0.86 KDM4E (0.45) MAOBHSD17B10ALDH1A1KDM4ELMNA
SCHEMBL19384624 0.86 MAOB (0.50) MAOBHSD17B10ALDH1A1KDM4ELMNA
SCHEMBL20897162 0.86 KDM4E (0.45) MAOBHSD17B10ALDH1A1KDM4ELMNA
SCHEMBL19384508 0.86 KDM4E (0.45) MAOBHSD17B10ALDH1A1KDM4ELMNA
SCHEMBL5830779 0.84 HSD17B10 (0.47) MAOBHSD17B10ALDH1A1KDM4ELMNA
SCHEMBL4349792 0.84 MAOB (0.55) MAOBHSD17B10ALDH1A1KDM4ELMNA

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-110494439-B Chiral biphenyl diphosphine ligand and preparation method thereof 帝斯曼知识产权资产管理有限公司 2022-11-08 CN disclosed