SCHEMBL5445869

SCHEMBL5445869

O=C(Nc1ccc2[nH]c3c(c2c1)CCCC3NC1CCCCC1)C1CCC1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RB1 P06400 6/20 0.57
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
BRD3 Q15059 3/20 0.47
MAPT P10636 2/20 0.47
ALOX15 P16050 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MAPK1 P28482 1/20 0.47
MEN1 O00255 1/20 0.46
GLA P06280 1/20 0.46
KMT2A Q03164 1/20 0.46
STK17B O94768 1/20 0.45
STK17A Q9UEE5 1/20 0.45
ITK Q08881 1/20 0.43
POLB P06746 1/20 0.43
CDC42 P60953 1/20 0.43
CYP2D6 P10635 1/20 0.43
SIRT1 Q96EB6 1/20 0.43

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
SCHEMBL5466568 0.99 RB1 (0.58) RB1MAOAMAOBBRD3MAPT
SCHEMBL5460471 0.97 RB1 (0.58) RB1MAOAMAOBBRD3MAPT
SCHEMBL5456655 0.85 RB1 (0.56) RB1BRD3MAPTALOX15SMN1; SMN2
SCHEMBL5449914 0.85 RB1 (0.56) RB1BRD3MAPTALOX15SMN1; SMN2
SCHEMBL5468135 0.84 RB1 (0.55) RB1BRD3MAPTALOX15SMN1; SMN2
SCHEMBL5451546 0.84 RB1 (0.55) RB1BRD3MAPTALOX15SMN1; SMN2
SCHEMBL5461886 0.82 RB1 (0.53) RB1BRD3MAPTALOX15SMN1; SMN2
SCHEMBL5456581 0.81 DHODH (0.64) RB1BRD3MAPTALOX15SMN1; SMN2
SCHEMBL5460533 0.81 RB1 (0.52) RB1BRD3MAPTALOX15SMN1; SMN2
SCHEMBL5452147 0.81 RB1 (0.57) RB1BRD3MAPTALOX15SMN1; SMN2

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 RB1 1821/4885MAOA 2594/4885MAOB 2400/4885

“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.