SCHEMBL1608515

SCHEMBL1608515

CCCCCCCCCCOc1ccc([N+](=O)[O-])c(C)c1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.69
SMN1; SMN2 Q16637 5/20 0.57
KDM4E B2RXH2 4/20 0.54
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
HTT P42858 1/20 0.53
LMNA P02545 2/20 0.51
POLB P06746 1/20 0.51
ALDH1A1 P00352 4/20 0.51
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
PLA2G4B P0C869 1/20 0.51
MAPK1 P28482 1/20 0.50

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
SCHEMBL16153093 1.00 MAPT (0.69) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL1608924 1.00 MAPT (0.69) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL10176166 0.98 MAPT (0.71) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL4835421 0.95 MAPT (0.70) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL11643791 0.92 MAPT (0.78) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL1141920 0.89 MAPT (0.70) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL10870559 0.88 MAPT (0.71) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL9277559 0.86 MAPT (0.61) MAPTSMN1; SMN2MEN1KMT2AHTT
SCHEMBL10982279 0.86 MAPT (0.56) MAPTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL10176162 0.85 MAPT (0.69) MAPTSMN1; SMN2KDM4EMEN1KMT2A

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102203066-A Novel dyes and use thereof in imaging members and methods ZINK IMAGING INC 2011-09-28 CN disclosed
US-20110080458-A1 NOVEL DYES AND USE THEREOF IN IMAGING MEMBERS AND METHODS ZINK IMAGING, INC. 2011-04-07 US disclosed
US-7704667-B2 Dyes and use thereof in imaging members and methods ZINK IMAGING, INC. (US) 2010-04-27 US disclosed
WO-2009097433-A1 NOVEL DYES AND USE THEREOF IN IMAGING MEMBERS AND METHODS ZINK IMAGING, INC. (US) 2009-08-06 WO disclosed
US-20080187866-A1 NOVEL DYES AND USE THEREOF IN IMAGING MEMBERS AND METHODS ZINK IMAGING, LLC 2008-08-07 US disclosed
US-20070224552-A1 PROCESS FOR THE PREPARATION OF NOVEL DYES FOR USE IN IMAGING MEMBERS ZINK IMAGING, LLC 2007-09-27 US disclosed
US-7220868-B2 Process for the preparation of novel dyes for use in imaging members ZINK IMAGING, LLC (US) 2007-05-22 US disclosed
US-20060234143-A1 Process for the preparation of novel dyes for use in imaging members ZINK IMAGING, LLC 2006-10-19 US disclosed
US-7008759-B2 Dyes and use thereof in imaging members and methods POLAROID CORPORATION (US) 2006-03-07 US disclosed
US-20040191668-A1 Novel dyes and use thereof in imaging members and methods ZINK HOLDINGS LLC 2004-09-30 US disclosed
WO-2004078875-A2 NOVEL DYES AND USE THEREOF IN IMAGING MEMBERS AND METHODS POLAROID CORPORATION (US) 2004-09-16 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 (3 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-20080187866-A1 NOVEL DYES AND USE THEREOF IN IMAGING MEMBERS AND METHODS CACYBP, KLHDC2, ZKSCAN2 MAPT 423/4885SMN1; SMN2 4599/4885KDM4E 3727/4885
US-20070224552-A1 PROCESS FOR THE PREPARATION OF NOVEL DYES FOR USE IN IMAGING MEMBERS CACYBP, ZKSCAN2, CRYAB MAPT 280/4885SMN1; SMN2 4420/4885KDM4E 3547/4885
US-20110080458-A1 NOVEL DYES AND USE THEREOF IN IMAGING MEMBERS AND METHODS CACYBP, KLHDC2, ZKSCAN2 MAPT 423/4885SMN1; SMN2 4599/4885KDM4E 3727/4885

“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.