SCHEMBL28334162

SCHEMBL28334162

CCCC[n+]1ccccc1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.41
RAB9A P51151 6/20 0.41
SMN1; SMN2 Q16637 6/20 0.41
KDM4E B2RXH2 6/20 0.41
HTT P42858 5/20 0.41
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
NPSR1 Q6W5P4 3/20 0.41
LMNA P02545 2/20 0.41
MAPK1 P28482 2/20 0.41
RAD52 P43351 2/20 0.41
RGS12 O14924 1/20 0.41
USP2 O75604 1/20 0.41
HSP90AA1 P07900 1/20 0.41
THRB P10828 1/20 0.41
MCL1 Q07820 1/20 0.41
POLB P06746 1/20 0.41
CES2 O00748 3/20 0.39
CES1 P23141 3/20 0.39
ALDH1A1 P00352 5/20 0.38

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
SCHEMBL28334165 0.89 CYP2D6 (0.39) NPC1RAB9ASMN1; SMN2KDM4EHTT
SCHEMBL8868691 0.85 NPC1 (0.41) NPC1RAB9ASMN1; SMN2KDM4EHTT
SCHEMBL21255684 0.85 MEN1 (0.44) NPC1RAB9ASMN1; SMN2KDM4EHTT
SCHEMBL28336498 0.82 SMN1; SMN2 (0.40) NPC1RAB9ASMN1; SMN2KDM4EHTT
SCHEMBL28336516 0.82 CYP2D6 (0.41) NPC1RAB9ASMN1; SMN2KDM4EHTT
SCHEMBL122095 0.81 HDAC1 (0.46) NPC1RAB9ASMN1; SMN2LMNAMAPK1
Hydrochloric Acid SCHEMBL28336408 0.80 CYP2D6 (0.40) NPC1RAB9ASMN1; SMN2KDM4EHTT
SCHEMBL124600 0.80 MAPT (0.46) NPC1RAB9ASMN1; SMN2MAPK1MCL1
SCHEMBL19582733 0.79 NPC1 (0.41) NPC1RAB9ASMN1; SMN2KDM4EHTT
SCHEMBL125473 0.79 MAPT (0.49) NPC1RAB9ASMN1; SMN2MAPK1MCL1

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-106661735-B Palladium plating solution and palladium coating film obtained using the same 日本高纯度化学株式会社 2019-12-10 CN claimed
CN-115748256-A Environment-friendly impregnation system for fiber surface treatment, preparation method thereof and impregnation treatment method 北京化工大学 2023-03-07 CN disclosed
CN-106661735-B Palladium plating solution and palladium coating film obtained using the same 日本高纯度化学株式会社 2019-12-10 CN disclosed
CN-104411707-B Substituted phenylimidazopyrazoles and their use 拜耳药业股份公司 2017-03-01 CN disclosed