SCHEMBL1628965

SCHEMBL1628965

C=C(CC1=CCCCCCC1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
HPGD P15428 4/20 0.43
TAAR1 Q96RJ0 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.40
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
EPHX1 P07099 2/20 0.40
NPSR1 Q6W5P4 4/20 0.40
KDM4E B2RXH2 2/20 0.40
GAA P10253 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
USP2 O75604 1/20 0.38
ALOX12 P18054 1/20 0.38
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37

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
SCHEMBL7994480 1.00 ALDH1A1 (0.43) ALDH1A1HPGDTAAR1SMN1; SMN2NPC1
SCHEMBL2127670 0.98 ALDH1A1 (0.44) ALDH1A1HPGDTAAR1SMN1; SMN2NPC1
SCHEMBL4290928 0.82 ALDH1A1 (0.46) ALDH1A1HPGDTAAR1SMN1; SMN2NPC1
SCHEMBL10569720 0.82 ALDH1A1 (0.46) ALDH1A1HPGDTAAR1SMN1; SMN2NPC1
SCHEMBL10568015 0.82 ALDH1A1 (0.46) ALDH1A1HPGDTAAR1SMN1; SMN2NPC1
SCHEMBL10568010 0.82 ALDH1A1 (0.46) ALDH1A1HPGDTAAR1SMN1; SMN2NPC1
SCHEMBL11626141 0.82 ALDH1A1 (0.46) ALDH1A1HPGDTAAR1SMN1; SMN2NPC1
SCHEMBL22607754 0.82 ALDH1A1 (0.46) ALDH1A1HPGDTAAR1SMN1; SMN2NPC1
SCHEMBL22607753 0.82 ALDH1A1 (0.46) ALDH1A1HPGDTAAR1SMN1; SMN2NPC1
SCHEMBL5925034 0.82 HPGD (0.47) ALDH1A1HPGDTAAR1SMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989544-B2 Amphiphilic polymer capsules and related methods of interfacial assembly UNIVERSITY OF MASSACHUSETTS (US) 2011-08-02 US disclosed
US-20110091533-A1 Amphiphilic polymer capsules and related methods of interfacial assembly NATIONAL SCIENCE FOUNDATION 2011-04-21 US disclosed
US-7851543-B2 Amphiphilic polymer capsules and related methods of interfacial assembly UNIVERSITY OF MASSACHUSETTS (US) 2010-12-14 US disclosed
US-20100036061-A1 Amphiphilic Polymer Capsules and Related Methods of Interfacial Assembly NATIONAL SCIENCE FOUNDATION 2010-02-11 US disclosed
US-7598313-B2 Amphiphilic polymer capsules and related methods of interfacial assembly UNIVERSITY OF MASSACHUSETTS (US) 2009-10-06 US disclosed
EP-1663469-A1 AMPHIPHILIC POLYMER CAPSULES AND RELATED METHODS OF INTERFACIAL ASSEMBLY The University of Massachusetts (US) 2006-06-07 EP disclosed
US-20050096454-A1 Amphiphilic polymer capsules and related methods of interfacial assembly UNIVERSITY OF MASSACHUSETTS 2005-05-05 US disclosed
WO-2005025736-A1 AMPHIPHILIC POLYMER CAPSULES AND RELATED METHODS OF INTERFACIAL ASSEMBLY UNIVERSITY OF MASSACHUSETTS (US) 2005-03-24 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-20110091533-A1 Amphiphilic polymer capsules and related methods of interfacial assembly SQLE, COASY, PHOSPHO1 ALDH1A1 4337/4885HPGD 636/4885TAAR1 1293/4885

“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.