SCHEMBL8280283

SCHEMBL8280283

CC(=O)Cc1cc([N+](=O)[O-])ccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.53
LMNA P02545 2/20 0.50
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 1/20 0.50
KMT2A Q03164 4/20 0.49
MEN1 O00255 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
RORC P51449 1/20 0.47
CYP1A2 P05177 1/20 0.46
POLB P06746 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
VCAM1 P19320 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
RAB9A P51151 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL13690070 0.86 HSD17B10 (0.51) HSD17B10LMNAKDM4EALDH1A1KMT2A
SCHEMBL2528182 0.85 CYP1A2 (0.64) HSD17B10LMNAKDM4EALDH1A1KMT2A
SCHEMBL7126585 0.85 HSD17B10 (0.55) HSD17B10LMNAKDM4EALDH1A1KMT2A
SCHEMBL3266897 0.85 CYP1A2 (0.64) HSD17B10LMNAKDM4EALDH1A1KMT2A
SCHEMBL27462575 0.84 HSD17B10 (0.53) HSD17B10LMNAKDM4EALDH1A1KMT2A
Water SCHEMBL6057599 0.84 CYP1A2 (0.62) HSD17B10LMNAKDM4EALDH1A1KMT2A
SCHEMBL28040574 0.84 KMT2A (0.55) HSD17B10LMNAKDM4EALDH1A1KMT2A
SCHEMBL23205017 0.83 TDP1 (0.55) HSD17B10LMNAKDM4EALDH1A1KMT2A
SCHEMBL14439930 0.83 POLB (0.50) HSD17B10LMNAKDM4EALDH1A1KMT2A
SCHEMBL5153725 0.82 GPR35 (0.51) LMNAALDH1A1KMT2AMEN1SMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325962-A1 TYROSINE DERIVATIVE GENENTECH, INC. (US) 2009-12-31 US disclosed
US-20090325962-A1 TYROSINE DERIVATIVE GENENTECH, INC. (US) 2009-12-31 US disclosed
US-20080075719-A1 Method for Augmenting B Cell Depletion GENENTECH, INC. (US) 2008-03-27 US disclosed
US-20080075719-A1 Method for Augmenting B Cell Depletion GENENTECH, INC. (US) 2008-03-27 US disclosed
EP-1214292-B1 TYROSINE DERIVATIVES GENENTECH INC (US) 2007-06-13 EP disclosed
WO-2005113003-A2 METHOD FOR AUGMENTING B CELL DEPLETION GENENTECH, INC. (US) 2005-12-01 WO 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 (2 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-20090325962-A1 TYROSINE DERIVATIVE VCAM1, ICAM1, ITGB4 HSD17B10 4240/4885LMNA 4443/4885KDM4E 227/4885
US-20080075719-A1 Method for Augmenting B Cell Depletion CD22, ITGAM, FCGR3B HSD17B10 4097/4885LMNA 2205/4885KDM4E 2616/4885

“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.