SCHEMBL1468463

SCHEMBL1468463

CN(C)c1ccc2c(c1)CN(c1ccc(CCCC(=O)O)cc1)C2=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
PARP1 P09874 1/20 0.41
SMN1; SMN2 Q16637 5/20 0.40
NFKB1 P19838 3/20 0.40
LMNA P02545 2/20 0.40
CYP2D6 P10635 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.40
GMNN O75496 1/20 0.40
GABRA1 P14867 1/20 0.40
TSHR P16473 1/20 0.40
THPO P40225 1/20 0.40
GABRA2 P47869 1/20 0.40
GABRB2 P47870 1/20 0.40
PMP22 Q01453 1/20 0.40
HIF1A Q16665 1/20 0.40
SLCO1B3 Q9NPD5 1/20 0.40
S1PR1 P21453 1/20 0.40

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
SCHEMBL1468582 0.91 RXRA (0.43) RXRARXRBRXRGPARP1SMN1; SMN2
Iodide SCHEMBL1468441 0.90 RXRA (0.43) RXRARXRBRXRGPARP1SMN1; SMN2
SCHEMBL1468193 0.87 CYP4Z1 (0.41) PARP1ADRA1AHTR1ANPC1RAB9A
SCHEMBL1470232 0.86 MLNR (0.41) PARP1SMN1; SMN2NFKB1LMNACYP2D6
SCHEMBL1468452 0.84 PPARD (0.43) PARP1SMN1; SMN2NFKB1LMNACYP2D6
SCHEMBL1468427 0.84 FAAH (0.43) PARP1ALDH1A1S1PR1ADRA1AHTR1A
SCHEMBL1468719 0.84 FAAH (0.43) PARP1ALDH1A1S1PR1ADRA1AHTR1A
SCHEMBL1468653 0.84 NPC1 (0.41) PARP1SMN1; SMN2NFKB1LMNACYP2D6
SCHEMBL1470274 0.82 PARP1 (0.40) RXRARXRBRXRGPARP1SMN1; SMN2
SCHEMBL1468602 0.80 RAB9A (0.60) RXRARXRBRXRGSMN1; SMN2NFKB1

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-8722723-B2 Aromatic amide derivative RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2014-05-13 US disclosed
US-20110071304-A1 AROMATIC AMIDE DERIVATIVE RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2011-03-24 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-20110071304-A1 AROMATIC AMIDE DERIVATIVE NCOR2, NCOR1, EP300 RXRA 241/4885RXRB 285/4885RXRG 244/4885

“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.