SCHEMBL31453487

SCHEMBL31453487

CCC(CC)NCCCCN(C)CCCCNC(CC)CC

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
CNR1 P21554 1/20 0.39
ADRA1A P35348 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ABCC3 O15438 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CHRM2 P08172 2/20 0.36
S1PR2 O95136 1/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
S1PR5 Q9H228 1/20 0.31
KDM5A P29375 3/20 0.30
KDM4C Q9H3R0 3/20 0.30
KDM5C P41229 1/20 0.30
KDM5B Q9UGL1 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
SCHEMBL31453486 0.93 LMNA (0.41) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL31453485 0.83 LMNA (0.44) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL31453481 0.83 LMNA (0.52) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL31453488 0.80 LMNA (0.50) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL31453480 0.80 LMNA (0.50) LMNACNR1ADRA1ATDP1KDM4E
Water SCHEMBL11967853 0.78 LMNA (0.48) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL31453483 0.77 LMNA (0.52) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL19214727 0.77 DNM1 (0.44) TDP1S1PR2S1PR1S1PR3S1PR5
SCHEMBL25569661 0.76 CHRM2 (0.39) LMNACHRM2
SCHEMBL7775237 0.75 TSHR (0.48) LMNACNR1ADRA1ATDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250296033-A1 ACID GAS REMOVAL METHOD AND ACID GAS REMOVAL SYSTEM KABUSHIKI KAISHA TOSHIBA (JP) 2025-09-25 US disclosed
US-20250090996-A1 ACID GAS REMOVAL METHOD, ACID GAS ABSORBENT, AND ACID GAS REMOVAL APPARATUS KABUSHIKI KAISHA TOSHIBA (JP) 2025-03-20 US disclosed