SCHEMBL7542762

SCHEMBL7542762

CCCCC(C)C(C)C(CC1CC1)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
CA2 P00918 1/20 0.38
MAPK1 P28482 1/20 0.38
TP53 P04637 1/20 0.36
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
CTSK P43235 1/20 0.36
ACE2 Q9BYF1 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CPB2 Q96IY4 1/20 0.34
GPR84 Q9NQS5 3/20 0.33
PTGES O14684 1/20 0.33
ALOX5 P09917 1/20 0.33
PPARG P37231 1/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
FFAR1 O14842 1/20 0.33
PKM P14618 1/20 0.33
METAP1 P53582 1/20 0.33

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
SCHEMBL7542290 1.00 MAPT (0.41) MAPTCA2MAPK1TP53CTSL
SCHEMBL13501676 0.80 CA2 (0.40) MAPTCA2MAPK1TP53CTSL
SCHEMBL13875765 0.80 CA2 (0.40) MAPTCA2MAPK1TP53CTSL
SCHEMBL4180381 0.80 CA2 (0.40) MAPTCA2MAPK1TP53CTSL
SCHEMBL4180378 0.80 CA2 (0.40) MAPTCA2MAPK1TP53CTSL
SCHEMBL4175026 0.80 CA2 (0.40) MAPTCA2MAPK1TP53CTSL
SCHEMBL13875766 0.76 MAPT (0.40) MAPTCA2MAPK1TP53CTSL
SCHEMBL4984284 0.76 CA2 (0.42) MAPTCA2MAPK1ACE2ALDH1A1
SCHEMBL15204045 0.74 CA2 (0.59) MAPTCA2MAPK1TP53ALDH1A1
SCHEMBL8421695 0.73 CA2 (0.50) MAPTCA2MAPK1ACE2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020156320-A1 Enantioselective synthesis of valproic acid analogues NAU HEINZ (DE) 2002-10-24 US claimed
US-20020156320-A1 Enantioselective synthesis of valproic acid analogues NAU HEINZ (DE) 2002-10-24 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-20020156320-A1 Enantioselective synthesis of valproic acid analogues COASY, ACADM, CYP2A6 MAPT 1368/4885CA2 460/4885MAPK1 4293/4885

“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.