SCHEMBL18532465

SCHEMBL18532465

CC(=O)NCCOCCOCCOCCC(=O)ON1C(=O)CCC1=O

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ HPGD P15428 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ MTNR1A P48039 5/20 0.34
▸ MTNR1B P49286 4/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPK1 P28482 2/20 0.32
▸ USP2 O75604 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ TLR2 O60603 1/20 0.31
▸ TLR1 Q15399 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ KDM4E B2RXH2 2/20 0.30
▸ HIF1A Q16665 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
SCHEMBL13056639 1.00 SMN1; SMN2 (0.36) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL12197747 1.00 SMN1; SMN2 (0.36) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL22202997 1.00 SMN1; SMN2 (0.36) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL13248325 0.99 SMN1; SMN2 (0.36) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL13248341 0.89 SMN1; SMN2 (0.40) SMN1; SMN2HPGDHTTKMT2AMTNR1A
SCHEMBL19170723 0.89 SMN1; SMN2 (0.34) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL19732577 0.89 SMN1; SMN2 (0.45) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL26199214 0.88 SMN1; SMN2 (0.34) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL22224280 0.88 SMN1; SMN2 (0.38) SMN1; SMN2HPGDHTTMEN1KMT2A
SCHEMBL23751331 0.87 SMN1; SMN2 (0.36) SMN1; SMN2HPGDHTTMEN1KMT2A

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
EP-2850061-B1 HALOGENATED INDOLE DERIVATIVES FOR PHOTODYNAMIC THERAPY NANOQUANTUM SCIENCES INC (US) 2020-09-16 — — EP disclosed
US-9839687-B2 Acetylenedicarboxyl linkers and their uses in specific conjugation of a cell-binding molecule SUZHOU M-CONJ BIOTECH CO., LTD. (CN) 2017-12-12 — — US disclosed
US-9572881-B2 Halogenated compounds for photodynamic therapy NANOQUANTUM SCIENCES, INC. (US) 2017-02-21 — — US disclosed
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