SCHEMBL9470200

SCHEMBL9470200

O=C(CCCOc1ccccc1C=CI)N1CCCC1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.59
RAB9A P51151 6/20 0.59
NPC1 O15118 6/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
KMT2A Q03164 6/20 0.58
MEN1 O00255 5/20 0.58
LMNA P02545 1/20 0.51
ALDH1A1 P00352 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
HTT P42858 1/20 0.50
MAPT P10636 4/20 0.46
POLB P06746 2/20 0.45
TDP1 Q9NUW8 1/20 0.44
GAA P10253 2/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL9470003 0.82 HPGD (0.63) HPGDRAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL9470013 0.79 PTGDR2 (0.49) HPGDSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL9470018 0.79 PTGDR2 (0.49) HPGDSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL9469512 0.77 KMT2A (0.48) HPGDRAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL9079165 0.76 KMT2A (0.65) HPGDRAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL9469063 0.75 MAPT (0.49) HPGDRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL9469062 0.75 MAPT (0.49) HPGDRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL9469663 0.73 LMNA (0.53) HPGDRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL9469150 0.73 LMNA (0.53) HPGDRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL9469148 0.73 LMNA (0.53) HPGDRAB9ANPC1SMN1; SMN2LMNA

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-5183925-A LEUKOTRIENE-B4 DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND THEIR USE AS PHARMACEUTICAL AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 1993-02-02 US disclosed