SCHEMBL5456584

SCHEMBL5456584

O=C(NCCCN1CCCC1=O)c1ccc2[nH]c3c(c2c1)CCCC3NCc1ccccc1F

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.53
KDM4E B2RXH2 2/20 0.53
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
HPGD P15428 1/20 0.46
MAPK1 P28482 2/20 0.45
POLB P06746 1/20 0.45
USP2 O75604 1/20 0.44
NAMPT P43490 2/20 0.44
FSHR P23945 1/20 0.44
KMT2A Q03164 2/20 0.44
TYRO3 Q06418 1/20 0.44
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
TSHR P16473 1/20 0.43
MAPT P10636 1/20 0.42

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
SCHEMBL5454743 0.94 ALDH1A1 (0.52) ALDH1A1KDM4ELMNASMN1; SMN2HPGD
SCHEMBL5461930 0.88 ALDH1A1 (0.48) ALDH1A1KDM4ELMNASMN1; SMN2HPGD
SCHEMBL5456598 0.86 HTR3A (0.54) KMT2A
SCHEMBL5458559 0.86 ALDH1A1 (0.49) ALDH1A1KDM4ELMNASMN1; SMN2HPGD
SCHEMBL5448116 0.85 MAPT (0.48) ALDH1A1KDM4ELMNASMN1; SMN2HPGD
SCHEMBL14388668 0.85 MAPT (0.46) ALDH1A1KDM4ELMNASMN1; SMN2HPGD
SCHEMBL5454063 0.84 ALDH1A1 (0.47) ALDH1A1KDM4ELMNASMN1; SMN2HPGD
SCHEMBL5453994 0.83 GAA (0.47) ALDH1A1KDM4ELMNASMN1; SMN2HPGD
SCHEMBL5456721 0.83 BRD3 (0.48) SMN1; SMN2MAPK1MAPT
SCHEMBL5452894 0.83 MAPK1 (0.51) ALDH1A1KDM4ELMNASMN1; SMN2HPGD

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-20070276009-A1 Compositions and Methods for Viral Inhibition CHIRON CORPORATION 2007-11-29 US disclosed
US-20070276009-A1 Compositions and Methods for Viral Inhibition CHIRON CORPORATION 2007-11-29 US disclosed
US-20070276009-A1 Compositions and Methods for Viral Inhibition CHIRON CORPORATION 2007-11-29 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-20070276009-A1 Compositions and Methods for Viral Inhibition MAVS, SARS1, ZC3HAV1 ALDH1A1 2322/4885KDM4E 2869/4885LMNA 4432/4885

“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.