SCHEMBL22947428

SCHEMBL22947428

O=S(=O)(O)CCCNc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 7/20 0.47
CA2 P00918 7/20 0.47
CA12 O43570 4/20 0.47
CA7 P43166 3/20 0.47
CA13 Q8N1Q1 3/20 0.47
HTT P42858 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
APP P05067 1/20 0.37
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
MMP13 P45452 1/20 0.30
PTGS1 P23219 1/20 0.30
PDE4A P27815 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL22946945 0.93 CA1 (0.47) CA1CA2CA12CA7CA13
SCHEMBL917966 0.73 MEN1 (0.44) CA1CA2CA12CA7MEN1
SCHEMBL6901692 0.71
SCHEMBL246721 0.71 ALDH1A1 (0.59) CA1CA2CA12MAPTLMNA
SCHEMBL574466 0.71 ALDH1A1 (0.33) CA1CA2MAPTAPP
SCHEMBL10889796 0.71 ALDH1A1 (0.41) MEN1MAPTKMT2ATSHRMAPK1
SCHEMBL15737107 0.69 HTT (0.47) CA1CA2CA12CA7CA13
SCHEMBL7049433 0.69 EPHX2 (0.32) MAPTAPP
SCHEMBL917583 0.69 ALDH1A1 (0.46) CA1CA2MEN1MAPTKMT2A
SCHEMBL1333377 0.69 ALDH1A1 (0.57) CA1CA2CA12MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11739022-B2 Functionalised bimodal periodic mesoporous organosilicates (PMOS) and method for producing same using pseudomorphic transformation Sentronic GmbH Gesellschaft für optische Meßsysteme (DE) 2023-08-29 US disclosed
US-20220144692-A1 FUNCTIONALISED BIMODAL PERIODIC MESOPOROUS ORGANOSILICATES (PMOS) AND METHOD FOR PRODUCING SAME USING PSEUDOMORPHIC TRANSFORMATION Sentronic GmbH Gesellschaft für optische Meßsysteme (DE) 2022-05-12 US disclosed
US-20210032157-A1 FUNCTIONALISED BIMODAL PERIODIC MESOPOROUS ORGANOSILICATES (PMOS) AND METHOD FOR PRODUCING SAME USING PSEUDOMORPHIC TRANSFORMATION Sentronic GmbH Gesellschaft für optische Meßsysteme (DE) 2021-02-04 US disclosed