SCHEMBL5483788

SCHEMBL5483788

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nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.44
SRR Q9GZT4 1/20 0.44
ALDH1A1 P00352 1/20 0.39
HMGCR P04035 1/20 0.39
CHRM1 P11229 1/20 0.39
TBXA2R P21731 1/20 0.39
ADRA1A P35348 1/20 0.39
ACLY P53396 3/20 0.37
CPT2 P23786 2/20 0.36
SLC22A6 Q4U2R8 1/20 0.33
LMNA P02545 1/20 0.33
FFAR1 O14842 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP2D6 P10635 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32

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
SCHEMBL31555508 0.78 HMGCR (0.48) LDHASRRALDH1A1HMGCRCHRM1
SCHEMBL27761178 0.78 HMGCR (0.48) LDHASRRALDH1A1HMGCRCHRM1
SCHEMBL16323032 0.78 HMGCR (0.38) LDHASRRHMGCRCHRM1TBXA2R
Tert-Butanol SCHEMBL9318334 0.76 HMGCR (0.46) LDHASRRALDH1A1HMGCRCHRM1
SCHEMBL52091 0.74 HMGCR (0.43) LDHASRRALDH1A1HMGCRCHRM1
SCHEMBL9298951 0.74 HMGCR (0.43) LDHASRRALDH1A1HMGCRCHRM1
SCHEMBL5211347 0.74 LDHA (0.42) LDHASRRALDH1A1HMGCRCHRM1
SCHEMBL8828363 0.74 LDHA (0.42) LDHASRRALDH1A1HMGCRCHRM1
SCHEMBL8849629 0.74 LMNA (0.35) LDHASRRALDH1A1HMGCRCHRM1
SCHEMBL23148171 0.74 HMGCR (0.44) LDHASRRALDH1A1HMGCRCHRM1

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-20070048337-A1 Aldol-crosslinked polymeric hydrogel adhesives ACTAMAX SURGICAL MATERIALS, LLC 2007-03-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070048337-A1 Aldol-crosslinked polymeric hydrogel adhesives ALDOA, ADSL, ALDH1A2 LDHA 123/4885SRR 2568/4885ALDH1A1 9/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.