SCHEMBL28038532

SCHEMBL28038532

CCC=C(C)C(=O)Oc1ccc(Br)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.44
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
MAPT P10636 4/20 0.41
LMNA P02545 3/20 0.41
MAPK1 P28482 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
S1PR4 O95977 1/20 0.41
S1PR1 P21453 1/20 0.41
MAOB P27338 4/20 0.41
RAB9A P51151 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 1/20 0.38
TP53 P04637 1/20 0.38
MAOA P21397 2/20 0.37
LDHA P00338 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL27882259 0.86 GSK3B (0.43) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL7874410 0.86 ELANE (0.40) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL28832427 0.85 KMT2A (0.47) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL27781517 0.85 TDP1 (0.40) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL27505728 0.85 CYP11B1 (0.42) MEN1KMT2AMAPTMAOBMAOA
SCHEMBL28289708 0.85 FAAH (0.41) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL432377 0.84 ELANE (0.42) MEN1KMT2AMAPTRAB9AL3MBTL1
SCHEMBL8102326 0.82 MAPT (0.43) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL28164412 0.82 F2 (0.40) MEN1KMT2AMAOBRAB9AKDM4E
SCHEMBL21065599 0.81 CYP1A2 (0.47) KMT2AMAPTLMNAMAOBL3MBTL1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105384867-A Polymer for preparing hydrophobic artificial lens GUANGDONG HEC PHARMACEUTICAL 2016-03-09 CN claimed
CN-116194805-A9 Colored contact lens 库博光学国际有限公司 2023-07-21 CN disclosed
CN-116194805-A Colored contact lens 库博光学国际有限公司 2023-05-30 CN disclosed
CN-104277720-B Adhesive composition, binder film, polarization plates and display device 三星SDI株式会社 2017-07-21 CN disclosed