SCHEMBL8919062

SCHEMBL8919062

O=C(c1ccccc1)N1CCCCCCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 1.00
ALDH1A1 P00352 5/20 0.85
USP2 O75604 1/20 0.85
MAPK1 P28482 1/20 0.75
LMNA P02545 2/20 0.71
L3MBTL1 Q9Y468 2/20 0.69
L3MBTL3 Q96JM7 1/20 0.66
SIGMAR1 Q99720 1/20 0.66
ACHE P22303 1/20 0.61
NPC1 O15118 2/20 0.61
RAB9A P51151 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
TP53 P04637 1/20 0.61
TSHR P16473 1/20 0.61
KDM4E B2RXH2 1/20 0.60
POLB P06746 1/20 0.60

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
SCHEMBL243236 1.00 HPGD (1.00) HPGDALDH1A1USP2MAPK1LMNA
SCHEMBL1927946 1.00 HPGD (1.00) HPGDALDH1A1USP2MAPK1LMNA
SCHEMBL27929296 1.00 HPGD (1.00) HPGDALDH1A1USP2MAPK1LMNA
SCHEMBL436090 1.00 HPGD (1.00) HPGDALDH1A1USP2MAPK1LMNA
Bicarbonate SCHEMBL1582960 0.98 HPGD (0.96) HPGDALDH1A1USP2MAPK1LMNA
Hydrochloric Acid SCHEMBL9209631 0.98 HPGD (0.96) HPGDALDH1A1USP2MAPK1LMNA
SCHEMBL254870 0.98 HPGD (0.96) HPGDALDH1A1USP2MAPK1LMNA
SCHEMBL18228404 0.98 HPGD (0.96) HPGDALDH1A1USP2MAPK1LMNA
SCHEMBL1263133 0.93 HPGD (0.88) HPGDALDH1A1USP2MAPK1LMNA
SCHEMBL2614241 0.91 HPGD (0.84) HPGDALDH1A1USP2MAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5648521-A DECYCLIZATION, OXIDATION HOECHST AKTIENGESELLSCHAFT (DE) 1997-07-15 US disclosed