SCHEMBL4444563

SCHEMBL4444563

CCCCC(CC)CC=CC(=O)Cl

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.44
ALDH1A1 P00352 6/20 0.44
TSHR P16473 4/20 0.42
CYP3A4 P08684 5/20 0.41
TDP1 Q9NUW8 3/20 0.41
ATM Q13315 1/20 0.41
MAPK1 P28482 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CA1 P00915 1/20 0.36
LMNA P02545 2/20 0.36
HSD17B10 Q99714 1/20 0.35
RECQL P46063 1/20 0.35

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
SCHEMBL8665357 0.84 ACHE (0.46) CA2ALDH1A1TSHRCYP3A4TDP1
SCHEMBL28113315 0.84 CA2 (0.46) CA2ALDH1A1TSHRCYP3A4TDP1
SCHEMBL2069188 0.84 ACHE (0.46) CA2ALDH1A1TSHRCYP3A4TDP1
SCHEMBL15572905 0.82 CA2 (0.44) CA2ALDH1A1TSHRCYP3A4TDP1
SCHEMBL27877490 0.79 TSHR (0.47) CA2ALDH1A1TSHRCYP3A4TDP1
SCHEMBL20640497 0.78 CA2 (0.41) CA2ALDH1A1TSHRCYP3A4TDP1
SCHEMBL23925191 0.78 ALDH1A1 (0.54) CA2ALDH1A1TSHRCYP3A4TDP1
SCHEMBL23925189 0.78 ALDH1A1 (0.54) CA2ALDH1A1TSHRCYP3A4TDP1
SCHEMBL10582207 0.77 HCAR2 (0.45) LMNA
SCHEMBL10459468 0.77 HCAR2 (0.45) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8378135-B2 Multifunctional alcohols obtained from cardanol, multifunctional acrylic crosslinker and pendant phosphorous flame retardant derivatives thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2013-02-19 US disclosed
US-20090240078-A1 MULTIFUNCTIONAL ALCOHOLS OBTAINED FROM CARDANOL, MULTIFUNCTIONAL ACRYLIC CROSSLINKER AND PENDANT PHOSPHOROUS FLAME RETARDANT DERIVATIVES THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2009-09-24 US disclosed
WO-2007077567-A1 MULTIFUNCTIONAL ALCOHOLS OBTAINED FROM CARDANOL, MULTIFUNCTIONAL ACRYLIC CROSSLINKER AND PENDANT PHOSPHOROUS FLAME RETARDANT DERIVATIVES THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2007-07-12 WO 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-20090240078-A1 MULTIFUNCTIONAL ALCOHOLS OBTAINED FROM CARDANOL, MULTIFUNCTIONAL ACRYLIC CROSSLINKER AND PENDANT PHOSPHOROUS FLAME RETARDANT DERIVATIVES THEREOF PFAS, PAOX, PFKFB2 CA2 3269/4885ALDH1A1 202/4885TSHR 2889/4885

“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.