SCHEMBL6692264

SCHEMBL6692264

O=[N+]([O-])c1ccc(C2CCNP(=O)(N(CCCl)CCCl)O2)cc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRYZ Q08257 2/20 0.60
NPSR1 Q6W5P4 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.32
POLB P06746 2/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
MAOB P27338 2/20 0.31
SLC18A3 Q16572 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
RECQL P46063 1/20 0.30
P2RY14 Q15391 1/20 0.30

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
SCHEMBL6695627 0.78 CRYZ (0.61) CRYZKDM4EALDH1A1LMNAPOLB
SCHEMBL6697964 0.77 CRYZ (0.65) CRYZALDH1A1LMNAPOLBGAA
SCHEMBL6693404 0.75 CRYZ (1.00) CRYZNPSR1KDM4EALOX15MAPK1
SCHEMBL974218 0.68 MEN1 (0.36) KDM4EALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL6691547 0.67 CRYZ (1.00) CRYZNPSR1KDM4EALOX15MAPK1
SCHEMBL6694531 0.65 CRYZ (0.60) CRYZNPSR1KDM4EALOX15MAPK1
SCHEMBL10556112 0.63 EPHX1 (0.47) ALDH1A1LMNAPOLBGAAMAPT
SCHEMBL28373802 0.63 SLC18A3 (0.45) CRYZKDM4EALDH1A1LMNAPOLB
SCHEMBL10556119 0.63 EPHX1 (0.47) ALDH1A1LMNAPOLBGAAMAPT
SCHEMBL10556132 0.63 EPHX1 (0.47) ALDH1A1LMNAPOLBGAAMAPT

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-20040214798-A1 Nitroaryl phosphoramide compositions and methods for targeting and inhibiting undesirable cell growth or proliferation HU, LONGQIN 2004-10-28 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-20040214798-A1 Nitroaryl phosphoramide compositions and methods for targeting and inhibiting undesirable cell growth or proliferation MKI67, NME2, NTPCR CRYZ 1190/4885NPSR1 1115/4885KDM4E 3196/4885

“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.