SCHEMBL10568920

SCHEMBL10568920

CCOC(=O)c1ccc(CN2CCNCC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.58
MAPK1 P28482 2/20 0.58
MAPT P10636 2/20 0.58
RAB9A P51151 2/20 0.58
TSHR P16473 1/20 0.58
STAT3 P40763 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
KDM4E B2RXH2 1/20 0.56
PRMT1 Q99873 1/20 0.51
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
CXCR4 P61073 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ATM Q13315 1/20 0.50
NPC1 O15118 1/20 0.50
TNF P01375 1/20 0.50
NOD2 Q9HC29 1/20 0.50
NOD1 Q9Y239 1/20 0.50
KCNJ1 P48048 1/20 0.49
KCNH2 Q12809 1/20 0.49

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
Hydrochloric Acid SCHEMBL10898517 0.99 LMNA (0.57) LMNAMAPK1MAPTRAB9ATSHR
SCHEMBL24673257 0.99 LMNA (0.57) LMNAMAPK1MAPTRAB9ATSHR
Bromide SCHEMBL29942515 0.97 LMNA (0.56) LMNAMAPK1MAPTRAB9ATSHR
SCHEMBL10397560 0.87 RAB9A (0.62) LMNAMAPK1MAPTRAB9ATSHR
SCHEMBL10900943 0.86 KCNH2 (0.66) LMNARAB9ASMN1; SMN2NPC1TNF
SCHEMBL345054 0.85 TSHR (0.60) LMNAMAPK1MAPTRAB9ATSHR
SCHEMBL3569140 0.85 CHKA (0.60) MAPK1MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL7499633 0.85 RAB9A (0.60) LMNAMAPK1MAPTRAB9ATSHR
Hydrochloric Acid SCHEMBL10901510 0.85 KCNH2 (0.65) LMNAMAPK1MAPTRAB9ATSHR
SCHEMBL347958 0.84 CHKA (0.62) LMNAMAPK1MAPTRAB9ATSHR

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
EP-4743446-A1 NITRO-CONTAINING COMPOUNDS THAT KILL MYCOBACTERIA Board of Trustees of Michigan State University (US) 2026-05-20 EP disclosed
WO-2025015066-A1 NITRO-CONTAINING COMPOUNDS THAT KILL MYCOBACTERIA BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2025-01-16 WO disclosed
US-4826974-A REARRANGEMENT OF SPIRO COMPOUND RHONE-POULENC SANTE (FR) 1989-05-02 US disclosed
US-4769366-A Novel 1,3-disubstituted pyrrolo[1,2-a]azepinone derivatives having anti-psychotic activity and pharmaceutical compositions containing them RHONE-POULENC SANTE (FR) 1988-09-06 US disclosed