SCHEMBL14447247

SCHEMBL14447247

CC(C)[C@H]1CCCC[C@@H]1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 4/20 0.42
SLC1A1 P43005 2/20 0.42
EPHX1 P07099 1/20 0.41
ACE P12821 1/20 0.41
KDM4E B2RXH2 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TAAR1 Q96RJ0 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 1/20 0.38
ALOX15 P16050 1/20 0.38
BLM P54132 1/20 0.38

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
SCHEMBL5513864 1.00 SLC1A2 (0.42) SLC1A2SLC1A1EPHX1ACEKDM4E
SCHEMBL12868799 1.00 SLC1A2 (0.42) SLC1A2SLC1A1EPHX1ACEKDM4E
SCHEMBL15592462 1.00 SLC1A2 (0.42) SLC1A2SLC1A1EPHX1ACEKDM4E
SCHEMBL10136513 1.00 SLC1A2 (0.42) SLC1A2SLC1A1EPHX1ACEKDM4E
SCHEMBL11295143 0.98 SLC1A2 (0.41) SLC1A2SLC1A1EPHX1ACEKDM4E
SCHEMBL10289797 0.95 ACE (0.44) SLC1A2SLC1A1EPHX1ACEKDM4E
SCHEMBL14473782 0.95 ACE (0.44) SLC1A2SLC1A1EPHX1ACEKDM4E
SCHEMBL14072902 0.95 ACE (0.44) SLC1A2SLC1A1EPHX1ACEKDM4E
SCHEMBL17628741 0.95 ACE (0.44) SLC1A2SLC1A1EPHX1ACEKDM4E
SCHEMBL14072906 0.95 ACE (0.44) SLC1A2SLC1A1EPHX1ACEKDM4E

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-20070191406-A1 Heterocyclic antiviral compounds ROCHE PALO ALTO LLC 2007-08-16 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-20070191406-A1 Heterocyclic antiviral compounds CCR5, CX3CR1, CXCR1 SLC1A2 1981/4885SLC1A1 795/4885EPHX1 1556/4885

“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.