SCHEMBL24819289

SCHEMBL24819289

COC(=O)c1cc(F)cc(OCCO)c1CBr

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 1/20 0.38
▸ SLC6A3 Q01959 1/20 0.38
▸ FFAR4 Q5NUL3 1/20 0.38
▸ HTT P42858 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPT P10636 3/20 0.34
▸ NPSR1 Q6W5P4 2/20 0.34
▸ HSP90AA1 P07900 2/20 0.34
▸ MTNR1A P48039 1/20 0.34
▸ MTNR1B P49286 1/20 0.34
▸ SCD O00767 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ CYP4F2 P78329 1/20 0.33
▸ CYP4A11 Q02928 1/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ CYP2C9 P11712 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
SCHEMBL24816881 0.92 FFAR4 (0.36) SLC6A4SLC6A3FFAR4HTTALDH1A1
SCHEMBL20766650 0.85 KDM4E (0.42) SLC6A4SLC6A3FFAR4HTTALDH1A1
SCHEMBL24744883 0.80 MTNR1A (0.34) FFAR4ALDH1A1MAPTNPSR1MTNR1A
SCHEMBL18878157 0.79 CES2 (0.39) SLC6A4SLC6A3ALDH1A1MAPTLMNA
SCHEMBL24571901 0.79 ALDH1A1 (0.43) SLC6A4SLC6A3HTTALDH1A1MAPT
SCHEMBL31727123 0.79 ALDH1A1 (0.43) SLC6A4SLC6A3HTTALDH1A1MAPT
SCHEMBL30296812 0.78 SOS1 (0.41) SLC6A4SLC6A3ALDH1A1MAPTKMT2A
SCHEMBL14719178 0.78 KDM4E (0.37) SLC6A4SLC6A3FFAR4HTTALDH1A1
SCHEMBL3410570 0.78 SOS1 (0.41) SLC6A4SLC6A3ALDH1A1MAPTKMT2A
SCHEMBL19305473 0.77 FFAR4 (0.36) SLC6A4SLC6A3FFAR4HTTALDH1A1

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-2022268229-A1 PROTEIN INHIBITOR OR DEGRADING AGENT, PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PHARMACEUTICAL USE 和径医药科技(上海)有限公司 2022-12-29 — — WO disclosed
Send feedback