SCHEMBL2780905

SCHEMBL2780905

NC(=O)c1ccc(Nc2ccccc2C(F)(F)F)cn1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 8/20 0.57
KIT P10721 6/20 0.57
KMT2A Q03164 1/20 0.50
SIRT2 Q8IXJ6 1/20 0.46
AURKA O14965 1/20 0.45
CDC7 O00311 1/20 0.45
ROCK2 O75116 1/20 0.45
MAP4K4 O95819 1/20 0.45
PIM1 P11309 1/20 0.45
PRKACA P17612 1/20 0.45
CDK7 P50613 1/20 0.45
CDK9 P50750 1/20 0.45
HIPK2 Q9H2X6 1/20 0.45
IRAK4 Q9NWZ3 1/20 0.45
PTK2 Q05397 3/20 0.44
MAPK8 P45983 2/20 0.42
MAPK10 P53779 2/20 0.42
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GRIN2D O15399 1/20 0.42

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
SCHEMBL27853658 0.88 AURKA (0.51) FLT3KITAURKA
SCHEMBL185694 0.86 AKR1C3 (0.47) FLT3KITKMT2AAURKAALDH1A1
SCHEMBL185950 0.84 FLT3 (0.55) FLT3KITKMT2APTK2MAPK8
Hydrochloric Acid SCHEMBL2805862 0.83 FLT3 (0.54) FLT3KITKMT2APTK2MAPK8
SCHEMBL2804906 0.82 FLT3 (0.53) FLT3KITKMT2APTK2MAPK10
SCHEMBL185676 0.79 KDM4E (0.41) FLT3KITKMT2AAURKAALDH1A1
SCHEMBL2808006 0.79 KDM4E (0.41) FLT3KITKMT2AAURKAALDH1A1
SCHEMBL2808003 0.79 KDM4E (0.41) FLT3KITKMT2AAURKAALDH1A1
Trifluoroacetic Acid SCHEMBL185939 0.78 FLT3 (0.49) FLT3KITKMT2AMAPK10
Trifluoroacetic Acid SCHEMBL185821 0.78 FLT3 (0.49) FLT3KITKMT2ACDC7ROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-62249790-A None JP disclosed
EP-2453320-B1 Multilayer volume hologram, and label for multilayer volume hologram fabrication DAINIPPON PRINTING CO LTD (JP) 2016-06-29 EP disclosed
US-20130222932-A1 WHITE LAMINATED POLYESTER FILM FOR REFLECTING SHEET TORAY INDUSTRIES, INC. (JP) 2013-08-29 US disclosed
US-20130131075-A1 NEW COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-05-23 US disclosed
US-20100240669-A1 NEW COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-23 US disclosed
EP-2228670-A1 WHITE LAMINATED POLYESTER FILM FOR REFLECTING SHEETS Toray Industries, Inc. (JP) 2010-09-15 EP disclosed
WO-2010097372-A1 COMPOUNDS AS BRADYKININ B1 ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-02 WO disclosed
US-6670096-B2 Support with a hydrophilic organic polymer compound chemically bonded to a surface, and an ionic compound bonded to the organic polymer FUJI PHOTO FILM CO., LTD. (JP) 2003-12-30 US disclosed
EP-0832913-B1 RANDOM SILOXANE COPOLYMER, PROCESS FOR PRODUCTION THEREOF, AND RESIN COMPOSITION CONTAINING THE COPOLYMER KANEGAFUCHI CHEMICAL IND (JP) 2003-09-24 EP disclosed
US-6596360-B2 Multilayer volume hologram, and label for multilayer volume hologram fabrication DAI NIPPON PRINTING CO., LTD. (JP) 2003-07-22 US disclosed
US-20020106583-A1 Support with a hydrophilic organic polymer compound chemically bonded to a surface, and an ionic compound bonded to the organic polymer FUJIFILM CORPORATION (JP) 2002-08-08 US disclosed
EP-1211096-A1 Base material for lithographic printing plate and lithographic printing plate using the same FUJI PHOTO FILM CO., LTD. (JP) 2002-06-05 EP disclosed
US-20020018253-A1 Multilayer volume hologram, and label for multilayer volume hologram fabrication DAI NIPPON PRINTING CO., LTD. 2002-02-14 US disclosed
EP-1168111-A2 Multilayer volume hologram, and label for multilayer volume hologram fabrication DAI NIPPON PRINTING CO., LTD. (JP) 2002-01-02 EP disclosed
US-6103837-A REACTING AT LEAST ONE POLYCARBONATE AND/OR DICARBONATE OF A DIOL AND, IF NEEDED, AT LEAST ONE DIESTER OF A DICARBOXYLIC ACID WITH AT LEAST ONE SPECIFIED SILICON COMPOUND IN THE PRESENCE OF AN ESTERIFYING OR ESTER EXCHANGE CATALYST KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2000-08-15 US disclosed
EP-0832913-A1 RANDOM SILOXANE COPOLYMER, PROCESS FOR PRODUCTION THEREOF, AND RESIN COMPOSITION CONTAINING THE COPOLYMER KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-04-01 EP disclosed
JP-S62249790-A THERMAL TRANSFER MEDIUM UNITIKA LTD 1987-10-30 JP disclosed
US-3954840-A THERMAL STABILITY TEIJIN LTD. (JA) 1976-05-04 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 (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-20130131075-A1 NEW COMPOUNDS ADORA1, H1-10, P2RY11 FLT3 632/4885KIT 989/4885KMT2A 4682/4885
US-20100240669-A1 NEW COMPOUNDS ADORA1, H1-10, P2RY11 FLT3 632/4885KIT 989/4885KMT2A 4682/4885

“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.