SCHEMBL374471

SCHEMBL374471

Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1N

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.70
MEN1 O00255 1/20 0.68
HTT P42858 1/20 0.68
RAB9A P51151 1/20 0.68
KMT2A Q03164 1/20 0.68
MAPK14 Q16539 3/20 0.67
CSF1R P07333 3/20 0.67
KIT P10721 2/20 0.67
LCK P06239 2/20 0.67
KDR P35968 1/20 0.67
BTK Q06187 1/20 0.67
KCNK3 O14649 2/20 0.67
KCNK9 Q9NPC2 1/20 0.67
BRAF P15056 6/20 0.65
MAPT P10636 1/20 0.64
ABL1 P00519 2/20 0.64
SRC P12931 2/20 0.64
P2RX1 P51575 1/20 0.63
LMNA P02545 1/20 0.63
DDR1 Q08345 1/20 0.62

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
Hydrochloric Acid SCHEMBL5004557 0.99 PTGS1 (0.68) PTGS1MEN1HTTRAB9AKMT2A
SCHEMBL10092868 0.90 CSF1R (0.55) PTGS1MEN1HTTRAB9AKMT2A
SCHEMBL2313285 0.90 MAPT (0.68) PTGS1MEN1HTTRAB9AKMT2A
SCHEMBL22025296 0.90 PTGS1 (0.70) PTGS1MEN1HTTRAB9AKMT2A
SCHEMBL30822434 0.90 PTGS1 (0.70) PTGS1MEN1HTTRAB9AKMT2A
SCHEMBL1358527 0.88 HDAC3 (0.58) PTGS1MEN1HTTRAB9AKMT2A
SCHEMBL12858422 0.88 MEN1 (0.73) PTGS1MEN1HTTRAB9AKMT2A
SCHEMBL1454873 0.87 PTGS1 (0.63) PTGS1MEN1HTTRAB9AKMT2A
SCHEMBL22025295 0.87 PTGS1 (0.64) PTGS1MEN1RAB9AKMT2AKIT
SCHEMBL24249928 0.86 MEN1 (0.70) PTGS1MEN1HTTRAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3912973-A2 SMALL MOLECULE MYRISTATE INHIBITORS OF BCR-ABL AND METHODS OF USE Dana-Farber Cancer Institute, Inc. (US) 2021-11-24 EP claimed
EP-3150593-A1 SMALL MOLECULE MYRISTATE INHIBITORS OF BCR-ABL AND METHODS OF USE Dana Farber Cancer Institute, Inc. (US) 2017-04-05 EP claimed
US-8921336-B2 Small molecule myristate inhibitors of BCR-ABL and methods of use DANA-FARBER CANCER INSTITUTE, INC. (US) 2014-12-30 US claimed
US-20110053932-A1 Protein Kinase Inhibitors and Methods for Using Thereof IRM LLC 2011-03-03 US claimed
US-7795273-B2 Pyrazolo[1,5-a]pyridine-3-carboxylic acids as EphB and VEGFR2 kinase inhibitors NOVARTIS AG (CH) 2010-09-14 US claimed
EP-2222162-A2 SMALL MOLECULE MYRISTATE INHIBITORS OF BCR-ABL AND METHODS OF USE Dana Farber Cancer Institute (US) 2010-09-01 EP claimed
US-20100093821-A1 3-Amino-pyrazole-4-carboxamide derivatives useful as inhibitors of protein kinases HOLZER PHILIPP 2010-04-15 US claimed
EP-2170842-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM, LLC (BM) 2010-04-07 EP claimed
US-7589101-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2009-09-15 US claimed
EP-2079702-A1 3-AMINO-PYRAZOLE-4-CARBOXAMIDE DERIVATIVES USEFUL AS INHIBITORS OF PROTEIN KINASES Novartis AG (CH) 2009-07-22 EP claimed
US-7338957-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2008-03-04 US claimed
EP-1841431-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2007-10-10 EP claimed
WO-2007065664-A2 PYRAZOLO[1,5-A]PYRIDINE-3-CARBOXYLIC ACIDS AS EPHB AND VEGFR2 KINASE INHIBITORS NOVARTIS AG (CH) 2007-06-14 WO claimed
EP-1786799-A1 NOVEL PHENYLAMINOPYRIMIDINE DERIVATIVES AS INHIBITORS OF BCR-ABL KINASE Natco Pharma Limited (IN) 2007-05-23 EP claimed
JP-2007504159-A 2007-03-01 JP claimed
WO-2007022268-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2007-02-22 WO claimed
WO-2006081172-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-08-03 WO claimed
EP-1658290-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-05-24 EP claimed
WO-2006027795-A1 NOVEL PHENYLAMINOPYRIMIDINE DERIVATIVES AS INHIBITORS OF BCR-ABL KINASE NATCO PHARMA LIMITED (IN) 2006-03-16 WO claimed
WO-2005039486-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2005-05-06 WO claimed

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-20110053932-A1 Protein Kinase Inhibitors and Methods for Using Thereof BMX, FRK, FYN PTGS1 2963/4885MEN1 4175/4885HTT 4201/4885
US-20100093821-A1 3-Amino-pyrazole-4-carboxamide derivatives useful as inhibitors of protein kinases MAP4K2, MAP4K3, MAP4K1 PTGS1 958/4885MEN1 3441/4885HTT 4606/4885

“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.