SCHEMBL8680348

SCHEMBL8680348

Cc1cc([N+](=O)[O-])cc2c1OC1(C=C2)N(C)c2ccccc2C1(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.53
LMNA P02545 6/20 0.53
TDP1 Q9NUW8 6/20 0.53
GAA P10253 4/20 0.53
NPSR1 Q6W5P4 4/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
RECQL P46063 3/20 0.53
ALPG P10696 1/20 0.53
TP53 P04637 1/20 0.53
ALOX15 P16050 1/20 0.53
HSD17B10 Q99714 1/20 0.53
GFER P55789 1/20 0.48
SMN1; SMN2 Q16637 8/20 0.43
MAPK1 P28482 3/20 0.43
THRB P10828 5/20 0.38
PKM P14618 2/20 0.38
TSHR P16473 2/20 0.38
PLIN1 O60240 1/20 0.38
PLIN5 Q00G26 1/20 0.38

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
SCHEMBL5573271 0.89 SMN1; SMN2 (0.55) MAPTLMNATDP1GAANPSR1
SCHEMBL8680301 0.89 MAPT (0.53) MAPTLMNATDP1GAANPSR1
SCHEMBL29473569 0.89 MAPT (0.50) MAPTLMNATDP1GAANPSR1
SCHEMBL13326515 0.89 MAPT (0.50) MAPTLMNATDP1GAANPSR1
SCHEMBL976219 0.89 MAPT (0.50) MAPTLMNATDP1GAANPSR1
SCHEMBL30612732 0.89 MAPT (0.50) MAPTLMNATDP1GAANPSR1
SCHEMBL8680089 0.88 MAPT (0.52) MAPTLMNATDP1GAANPSR1
SCHEMBL8680948 0.88 MAPT (0.52) MAPTLMNATDP1GAANPSR1
SCHEMBL13889699 0.88 MAPT (0.57) MAPTLMNATDP1GAANPSR1
SCHEMBL8680104 0.88 MAPT (0.52) MAPTLMNATDP1GAANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5759729-A A DRY TONER COMPRISING A RESIN, PHOTOCHROMATIC SPIROPYRAN, -OXAZINE OR -THIOPYRAN DYE AND A CHARGE CONTROL AGENT;ELECTROGRAPHY; XEROGRAPHY XEROX CORPORATION (US) 1998-06-02 US claimed
US-20170186514-A1 STRAIN GAUGE POLYMER COMPRISING PHOTOCHROMIC COLORANT XEROX CORPORATION 2017-06-29 US disclosed
US-20110287549-A1 TIME TEMPERATURE INDICATOR BASED ON THIOALKYL AND THIOARYL SUBSTITUTED SPIROAROMATICS FRESHPOINT HOLDINGS SA (CH) 2011-11-24 US disclosed
US-20110092364-A1 OLIGOMERIC SPIROPYRANS FOR ERASABLE MEDIUM APPLICATIONS XEROX CORPORATION (US) 2011-04-21 US disclosed
US-5759729-A A DRY TONER COMPRISING A RESIN, PHOTOCHROMATIC SPIROPYRAN, -OXAZINE OR -THIOPYRAN DYE AND A CHARGE CONTROL AGENT;ELECTROGRAPHY; XEROGRAPHY XEROX CORPORATION (US) 1998-06-02 US disclosed
US-5710420-A Method for embedding and recovering machine-readable information XEROX CORPORATION (US) 1998-01-20 US disclosed
US-5633109-A Ink compositions with liposomes containing photochromic compounds XEROX CORPORATION (US) 1997-05-27 US disclosed
US-5593486-A Photochromic hot melt ink compositions XEROX CORPORATION (US) 1997-01-14 US disclosed
US-5551973-A LIQUID CRYSTAL GEL PHASE, MICROEMULSION PHASE XEROX CORPORATION (US) 1996-09-03 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-20110287549-A1 TIME TEMPERATURE INDICATOR BASED ON THIOALKYL AND THIOARYL SUBSTITUTED SPIROAROMATICS TPI1, TTI1, TST MAPT 2384/4885LMNA 1341/4885TDP1 904/4885

“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.