SCHEMBL5450424

SCHEMBL5450424

O=C(NC[C@H]1CCCO1)c1ccc2[nH]c3c(c2c1)CCCC3NC1CCCCC1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.60
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
RB1 P06400 4/20 0.52
ALDH1A1 P00352 5/20 0.49
KDM4E B2RXH2 3/20 0.48
HPGD P15428 7/20 0.48
HSD17B10 Q99714 3/20 0.48
GAA P10253 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
GLA P06280 1/20 0.47
LMNA P02545 1/20 0.47

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
SCHEMBL5455606 1.00 RAB9A (0.60) RAB9AKMT2AMEN1RB1ALDH1A1
SCHEMBL5458983 1.00 RAB9A (0.60) RAB9AKMT2AMEN1RB1ALDH1A1
SCHEMBL5468069 0.89 RB1 (0.55) RAB9AKMT2AMEN1RB1ALDH1A1
SCHEMBL5451949 0.86 RB1 (0.56) RAB9AKMT2AMEN1RB1KDM4E
SCHEMBL5456566 0.86 RB1 (0.56) RAB9AKMT2AMEN1RB1KDM4E
SCHEMBL5451412 0.85 RB1 (0.56) RAB9AKMT2AMEN1RB1KDM4E
SCHEMBL5449883 0.83 RB1 (0.61) RAB9AKMT2AMEN1RB1GAA
SCHEMBL5454061 0.83 RB1 (0.53) RAB9AKMT2AMEN1RB1ALDH1A1
SCHEMBL5459696 0.83 RB1 (0.60) RAB9AKMT2AMEN1RB1ALDH1A1
SCHEMBL5456622 0.83 RB1 (0.61) RB1ALDH1A1SMN1; SMN2LMNA

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 RAB9A 2512/4885KMT2A 4049/4885MEN1 4748/4885

“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.