SCHEMBL24828142

SCHEMBL24828142

CCC1CCCCCCCCCCCCCNCCCC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
CYP1A2 P05177 1/20 0.41
HTT P42858 1/20 0.40
SIGMAR1 Q99720 1/20 0.36
SHBG P04278 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
CXCR4 P61073 1/20 0.32
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
ACHE P22303 1/20 0.31
CHRM5 P08912 2/20 0.31
ADRA2C P18825 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM1 P11229 1/20 0.31

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
SCHEMBL21038251 0.98 ALDH1A1 (0.43) ALDH1A1CYP1A2HTTSIGMAR1SHBG
SCHEMBL414789 0.97 HTT (0.41) ALDH1A1CYP1A2HTTSIGMAR1SMN1; SMN2
SCHEMBL25707964 0.95 ALDH1A1 (0.41) ALDH1A1CYP1A2HTTSIGMAR1
SCHEMBL18638609 0.95 ALDH1A1 (0.41) ALDH1A1CYP1A2HTTSIGMAR1
SCHEMBL27395795 0.95 HTT (0.40) ALDH1A1CYP1A2HTTSIGMAR1SMN1; SMN2
SCHEMBL13547365 0.93 HTT (0.39) ALDH1A1CYP1A2HTTSIGMAR1SMN1; SMN2
SCHEMBL21535942 0.90 SMN1; SMN2 (0.35) ALDH1A1CYP1A2HTTSIGMAR1SMN1; SMN2
SCHEMBL25015337 0.86 CYP1A2 (0.38) ALDH1A1CYP1A2HTT
SCHEMBL16511457 0.86 CYP1A2 (0.38) ALDH1A1CYP1A2HTT
SCHEMBL12642 0.85

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-11541470-B2 Methods of furnace-less brazing GENERAL ELECTRIC COMPANY (US) 2023-01-03 US disclosed