SCHEMBL8775699

SCHEMBL8775699

COc1cc([N+](=O)[O-])cc2c1OC1(C=C2)N(Cc2ccc(F)cc2)c2ccccc2C1(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
LMNA P02545 4/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
GAA P10253 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
RECQL P46063 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
PLIN1 O60240 1/20 0.42
THRB P10828 1/20 0.42
PKM P14618 1/20 0.42
TSHR P16473 1/20 0.42
PLIN5 Q00G26 1/20 0.42
ABHD5 Q8WTS1 1/20 0.42
MDM2 Q00987 4/20 0.38
TP53 P04637 3/20 0.35
NPSR1 Q6W5P4 2/20 0.35
ALPG P10696 1/20 0.35
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL12265911 0.96 MAPT (0.44) MAPTLMNAMEN1KMT2AGAA
SCHEMBL8776080 0.94 MAPT (0.43) MAPTLMNAMEN1KMT2AGAA
SCHEMBL12787008 0.93 MAPT (0.43) MAPTLMNAMEN1KMT2AGAA
SCHEMBL12787013 0.93 MAPT (0.43) MAPTLMNAMEN1KMT2AGAA
SCHEMBL12265918 0.93 MEN1 (0.44) MAPTLMNAMEN1KMT2AGAA
SCHEMBL12147205 0.92 MAPT (0.42) MAPTLMNAMEN1KMT2AGAA
SCHEMBL8775782 0.92 MEN1 (0.42) MAPTLMNAMEN1KMT2AGAA
SCHEMBL14141068 0.92 MAPT (0.44) MAPTLMNAMEN1KMT2AGAA
SCHEMBL13491013 0.92 MAPT (0.41) MAPTLMNAMEN1KMT2AGAA
SCHEMBL13828516 0.92 MAPT (0.42) MAPTLMNAMEN1KMT2AGAA

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8501053-B2 Multi color, photoactive, color changing compositions and UV dosimeters BASF SE (DE) 2013-08-06 US disclosed
US-8403558-B2 TTI indicator with balanced photochemical processes BIZERBA GMBH & CO. KG (DE) 2013-03-26 US disclosed
US-8403558-B2 TTI indicator with balanced photochemical processes BIZERBA GMBH & CO. KG (DE) 2013-03-26 US disclosed
US-20130026428-A1 PREPARATION OF A PHOTOCHROMIC INK BASF SE (DE) 2013-01-31 US disclosed
US-20120288690-A1 MULTI COLOR, PHOTOACTIVE, COLOR CHANGING COMPOSITIONS BASF SE (DE) 2012-11-15 US disclosed
US-8287776-B2 Preparation of a photochromic ink BASF SE (DE) 2012-10-16 US disclosed
EP-2102307-B1 PHOTOSTABILIZED TIME TEMPERATURE INDICATOR FRESHPOINT HOLDINGS SA (CH) 2012-05-23 EP disclosed
US-20110297898-A1 PREPARATION OF A PHOTOCHROMIC INK BASF SE (DE) 2011-12-08 US disclosed
US-20110297898-A1 PREPARATION OF A PHOTOCHROMIC INK BASF SE (DE) 2011-12-08 US disclosed
US-20110217786-A1 OPTIMIZED TIME TEMPERATURE INDICATOR BIZERBA GMBH & CO. KG (DE) 2011-09-08 US disclosed
US-20100135353-A1 TTI INDICATOR WITH BALANCED PHOTOCHEMICAL PROCESSES CIBA CORPORATION (US) 2010-06-03 US disclosed
US-20100135353-A1 TTI INDICATOR WITH BALANCED PHOTOCHEMICAL PROCESSES CIBA CORPORATION (US) 2010-06-03 US disclosed
US-20100034961-A1 PHOTOSTABILIZED TIME TEMPERATURE INDICATOR FRESHPOINT HOLDINGS SA (CH) 2010-02-11 US disclosed
US-20100034961-A1 PHOTOSTABILIZED TIME TEMPERATURE INDICATOR FRESHPOINT HOLDINGS SA (CH) 2010-02-11 US disclosed
WO-2009127529-A1 OPTIMIZED TIME TEMPERATURE INDICATOR BASF SE (DE) 2009-10-22 WO disclosed
WO-2008083895-A1 TTI INDICATOR WITH BALANCED PHOTOCHEMICAL PROCESSES CIBA HOLDING INC. (CH) 2008-07-17 WO disclosed
WO-2008083925-A1 PHOTOSTABILIZED TIME TEMPERATURE INDICATOR FRESHPOINT HOLDINGS SA (CH) 2008-07-17 WO disclosed
US-20080167183-A1 Light absorbing layer for photo-chromic systems CIBA CORPORATION 2008-07-10 US disclosed
US-20080167183-A1 Light absorbing layer for photo-chromic systems CIBA CORPORATION 2008-07-10 US disclosed
WO-2008049755-A2 LIGHT ABSORBING LAYER FOR PHOTO-CHROMIC SYSTEMS CIBA HOLDING INC. (CH) 2008-05-02 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-20110297898-A1 PREPARATION OF A PHOTOCHROMIC INK RB1, REN, MYH14 MAPT 1266/4885LMNA 299/4885MEN1 3052/4885
US-20100034961-A1 PHOTOSTABILIZED TIME TEMPERATURE INDICATOR TTI1, NQO2, CCNI MAPT 3732/4885LMNA 948/4885MEN1 828/4885

“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.