SCHEMBL1383591

SCHEMBL1383591

C=CC(=O)Nc1ccc(F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 10/20 1.00
F13A1 P00488 1/20 0.66
LMNA P02545 1/20 0.66
TGM1 P22735 1/20 0.66
TGM3 Q08188 1/20 0.66
MEN1 O00255 1/20 0.61
KMT2A Q03164 1/20 0.61
KDR P35968 1/20 0.57
TEK Q02763 1/20 0.57
ALDH1A1 P00352 1/20 0.55
MMP1 P03956 2/20 0.54
MMP2 P08253 2/20 0.54
MMP9 P14780 2/20 0.54
EGFR P00533 2/20 0.54
THRA P10827 1/20 0.50
THRB P10828 1/20 0.50
ITK Q08881 1/20 0.49
NPC1 O15118 1/20 0.49
TP53 P04637 1/20 0.49
POLB P06746 1/20 0.49

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
SCHEMBL439369 0.89 TGM2 (0.79) TGM2F13A1LMNATGM1TGM3
SCHEMBL133445 0.81 TGM2 (0.68) TGM2F13A1LMNATGM1TGM3
SCHEMBL7270679 0.81 TGM2 (0.68) TGM2F13A1LMNATGM1TGM3
SCHEMBL28703875 0.81 TGM2 (0.68) TGM2F13A1LMNATGM1TGM3
SCHEMBL24968524 0.81 TGM2 (0.66) TGM2F13A1LMNATGM1TGM3
SCHEMBL19393388 0.79 TGM2 (0.66) TGM2F13A1LMNATGM1TGM3
SCHEMBL7785803 0.79 TGM2 (0.66) TGM2F13A1LMNATGM1TGM3
SCHEMBL1381911 0.79 TGM2 (0.66) TGM2F13A1LMNATGM1TGM3
SCHEMBL6358305 0.79 TGM2 (0.71) TGM2F13A1LMNATGM1TGM3
SCHEMBL3064236 0.79 TGM2 (0.66) TGM2F13A1LMNATGM1TGM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118955381-A Pyrazole compound as well as preparation method and application thereof 赣南师范大学 2024-11-15 CN claimed
JP-4828407-B2 2011-11-30 JP claimed
EP-1594869-A2 3-SUBSTITUTED-2(ARYLALKYL)-1-AZABICYCLOALKANES AND METHODS OF USE THEREOF Targacept, Inc. (US) 2005-11-16 EP claimed
WO-2004076449-A2 3-SUBSTITUTED-2(ARYLALKYL)-1-AZABICYCLOALKANES AND METHODS OF USE THEREOF TARGACEPT, INC. (US) 2004-09-10 WO claimed
CN-118955381-A Pyrazole compound as well as preparation method and application thereof 赣南师范大学 2024-11-15 CN disclosed
CN-118221564-A Preparation method of branched-chain alcohol-containing hydroxy indolone 滁州学院 2024-06-21 CN disclosed
US-20240043394-A1 PROTEASOME ENHANCERS AND USES THEREOF BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2024-02-08 US disclosed
CN-117263760-A Method for synthesizing tetrahydrobenzene-1-formamide compound by photocatalysis 西南医科大学 2023-12-22 CN disclosed
US-20210369731-A1 COVALENT TARGETING OF E3 LIGASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-12-02 US disclosed
US-10676554-B2 Polymer compound, film obtained by hardening this polymer compound and electronic device comprising this film SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-06-09 US disclosed
US-20200062696-A1 COMPOSITIONS AND METHODS FOR INHIBITING RETICULON 4 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-02-27 US disclosed
US-20200062696-A1 COMPOSITIONS AND METHODS FOR INHIBITING RETICULON 4 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-02-27 US disclosed
WO-2018144870-A1 COMPOSITIONS AND METHODS FOR INHIBITING RETICULON 4 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-08-09 WO disclosed
US-8895551-B2 Acrylamide compounds and the use thereof SHIONOGI & CO., LTD. (JP) 2014-11-25 US disclosed
US-20120022069-A1 ACRYLAMIDE COMPOUNDS AND THE USE THEREOF SHIONOGI & CO., LTD. (JP) 2012-01-26 US disclosed
EP-1099692-B1 N,N-SUBSTITUTED CYCLIC AMINE DERIVATIVES EISAI CO LTD (JP) 2006-05-03 EP disclosed
EP-1594869-A2 3-SUBSTITUTED-2(ARYLALKYL)-1-AZABICYCLOALKANES AND METHODS OF USE THEREOF Targacept, Inc. (US) 2005-11-16 EP disclosed
WO-2004076449-A2 3-SUBSTITUTED-2(ARYLALKYL)-1-AZABICYCLOALKANES AND METHODS OF USE THEREOF TARGACEPT, INC. (US) 2004-09-10 WO disclosed
US-6737425-B1 SUCH AS 1-((4-CYANO-5-METHYL-4-PHENYL)HEXYL)-4-(2-(4-FLUORO -PHENOXY)ETHYL)PIPERAZINE; NERVE SELECTIVE CALCIUM ANTAGONISTS EISAI CO., LTD. (JP) 2004-05-18 US disclosed
EP-1099692-A1 N,N-SUBSTITUTED CYCLIC AMINE DERIVATIVES Eisai Co., Ltd. (JP) 2001-05-16 EP 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 (4 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-20200062696-A1 COMPOSITIONS AND METHODS FOR INHIBITING RETICULON 4 RTN4, RTN3, RCN1 TGM2 2492/4885F13A1 3453/4885LMNA 2148/4885
US-20120022069-A1 ACRYLAMIDE COMPOUNDS AND THE USE THEREOF TRPA1, TRPV1, CACNA1B TGM2 3257/4885F13A1 2553/4885LMNA 2615/4885
US-20210369731-A1 COVALENT TARGETING OF E3 LIGASES RNF114, RNF4, RNF168 TGM2 3684/4885F13A1 4169/4885LMNA 3321/4885
US-20240043394-A1 PROTEASOME ENHANCERS AND USES THEREOF PSME3, PSME1, PSMB5 TGM2 2848/4885F13A1 4792/4885LMNA 3499/4885

“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.