SCHEMBL24065978

SCHEMBL24065978

CCOC(=O)[C@H]1[C@H](C(=O)OCC)N1c1ccc(OC)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.60
ALDH1A1 P00352 8/20 0.51
KDM4E B2RXH2 3/20 0.51
HPGD P15428 2/20 0.51
PDE4D Q08499 1/20 0.48
MAPT P10636 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
TSHR P16473 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
GAA P10253 4/20 0.46
NPC1 O15118 2/20 0.45
RAB9A P51151 1/20 0.45
LMNA P02545 1/20 0.44
HSD17B10 Q99714 1/20 0.44
POLB P06746 2/20 0.44
GLA P06280 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
SCHEMBL24065915 1.00 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1KDM4EHPGDPDE4D
SCHEMBL16815043 0.88 SMN1; SMN2 (0.49) SMN1; SMN2ALDH1A1KDM4EHPGDMAPT
SCHEMBL16812856 0.88 SMN1; SMN2 (0.49) SMN1; SMN2ALDH1A1KDM4EHPGDMAPT
SCHEMBL24065914 0.81 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1KDM4EHPGDPDE4D
SCHEMBL24065979 0.81 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1KDM4EHPGDPDE4D
SCHEMBL8260150 0.80 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1KDM4EHPGDPDE4D
SCHEMBL17977269 0.80 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1KDM4EHPGDPDE4D
SCHEMBL7434354 0.80 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1KDM4EHPGDPDE4D
SCHEMBL7436135 0.79 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1KDM4EHPGDPDE4D
SCHEMBL7430439 0.79 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1KDM4EHPGDPDE4D

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-11814452-B2 Aziridine polymers whose chemical structural changes are induced by mechanical force KOREA UNIVERSITY RESEARCH AND BUSINESS FOUNDATION (KR) 2023-11-14 US disclosed
US-11814452-B2 Aziridine polymers whose chemical structural changes are induced by mechanical force KOREA UNIVERSITY RESEARCH AND BUSINESS FOUNDATION (KR) 2023-11-14 US disclosed
US-20210371557-A1 AZIRIDINE POLYMERS WHOSE CHEMICAL STRUCTURAL CHANGES ARE INDUCED BY MECHANICAL FORCE KOREA UNIVERSITY RESEARCH AND BUSINESS FOUNDATION (KR) 2021-12-02 US disclosed